Browse
Submit Data
Databases
API
Help

Dataset Information

0 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

2-[(2-Hydr-oxy-1-naphth-yl)methyl-ene-amino]-1,3-benzothia-zole.

ABSTRACT: In the title compound, C(18)H(12)N(2)OS, the dihedral angle between the mean planes of the aromatic ring systems is 7.26?(8)°. There is an intra-molecular O-H?N hydrogen bond, forming a six-membered ring. In the crystal structure, inter-molecular C-H?N hydrogen bonds link the mol-ecules into a one-dimensional chain.

SUBMITTER: Cui L

PROVIDER: S-EPMC2959411 | biostudies-other | 2008

REPOSITORIES: biostudies-other

ACCESS DATA

Json Xml

Publications

2-[(2-Hydr-oxy-1-naphth-yl)methyl-ene-amino]-1,3-benzothia-zole.

Cui Liansheng L Yin Handong H Yang Minglei M Quan Li L Wang Daqi D

Acta crystallographica. Section E, Structure reports online 20080920 Pt 10

In the title compound, C(18)H(12)N(2)OS, the dihedral angle between the mean planes of the aromatic ring systems is 7.26 (8)°. There is an intra-molecular O-H⋯N hydrogen bond, forming a six-membered ring. In the crystal structure, inter-molecular C-H⋯N hydrogen bonds link the mol-ecules into a one-dimensional chain. ...[more]

PMID: 21201174

Similar Datasets

2-Hydr-oxy-N'-[(E)-(3-hydr-oxy-2-naphth-yl)methyl-ene]benzohydrazide.

Project description:In the title mol-ecule, C(18)H(14)N(2)O(3), O-H?N and N-H?O hydrogen bonds influence the mol-ecular conformation; the benzene and naphthalene planes are inclined at a dihedral angle of 11.54?(5)°. In the crystal structure, inter-molecular O-H?O hydrogen bonds link the mol-ecules into chains running in the [01] direction.

| S-EPMC2968222 | biostudies-literature

4-[(2-Hydr-oxy-1-naphth-yl)methyl-idene-amino]benzoic acid.

Project description:The mol-ecule of the title compound, C(18)H(13)NO(3), is almost planar, the dihedral angle between the naphthalene and benzene ring systems being 4.04 (6)°. The mol-ecular conformation and packing are stabilized by intra-molecular O-H⋯N and inter-molecular O-H⋯O and C-H⋯O inter-actions.

| S-EPMC2960922 | biostudies-literature

2-(4-Amino-phen-yl)-1,3-benzothia-zole.

Project description:The title compound, C(13)H(10)N(2)S, contains two independent mol-ecules in its asymmetric unit, with slightly different conformations. In one mol-ecule, the dihedral angle between the benzothia-zole unit and the benzene ring is 6.73 (1)°, while the corresponding angle in the other mol-ecule is 1.8 (1)°. In the crystal structure, the mol-ecules are linked into layers by N-H⋯N hydrogen bonds.

| S-EPMC2959689 | biostudies-literature

Methyl 2-[2-(tert-but-oxy-carbonyl-amino)-1,3-benzothia-zole-6-carboxamido]-acetate.

Project description:In the title compound, C(16)H(19)N(3)O(5)S, the dihedral angle between the benzene ring and the carbonyl-amino group is 18.18 (2)°. In the crystal, mol-ecules form centrosymmetric dimers via pairs of N-H⋯N hydrogen bonds. The dimers are connected via N-H⋯O hydrogen bonds into a three-dimensional network..

| S-EPMC3254462 | biostudies-literature

2,2'-(Sulfanediyldimethyl-ene)bis-(1,3-benzothia-zole).

Project description:In the title compound, C(16)H(12)N(2)S(3), the two benzothia-zole groups are oriented differently with respect to the -CH(2)- groups, one being approximately staggered and one nearly eclipsed. A sulfur-π inter-action of 3.3627 (11) Å is observed between the bridging thio-ether S atom and a thia-zole ring. The crystal packing is further stabilized by inter-molecular C-H⋯N and C-H⋯π inter-actions.

| S-EPMC3052028 | biostudies-literature

2-[3-(1,3-Benzothia-zol-2-yl)-2,2-di-methyl-prop-yl]-2-methyl-2,3-di-hydro-1,3-benzothia-zole.

Project description:In the title compound, C(20)H(22)N(2)S(2), the five-membered thia-zole ring of the 2-methyl-2,3-dihydro-1,3-benzothia-zole unit has an envelope conformation. The dihedral angle between the planar [maximum deviation of 0.014?(1)?Å for the S atom] benzothia-zole ring system and the benzene ring is 78.37?(12)°. Two intra-molecular C-H?S hydrogen bonds are observed, forming rings of graph-set motif S(6). In the crystal, the molecules are consolidated in pairs through N-H?N hydrogen bonds and are arranged parallel to the b axis.

| S-EPMC3414284 | biostudies-literature

5-Chloro-2-(3,4,5-trimeth-oxy-phen-yl)-1,3-benzothia-zole.

Project description:In the title compound, C(16)H(14)ClNO(3)S, the dihedral angle between the almost-planar benzothia-zole ring system [maximum deviation = 0.012?(3)?Å] and the aromatic ring of the trimeth-oxy-phenyl group is 15.56?(6)°. In the crystal, the mol-ecules are arranged into layers parallel to the bc plane, held together only by weak van der Waals forces.

| S-EPMC3470404 | biostudies-literature

2-[5-(4-Meth-oxy-phen-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-6-methyl-1,3-benzothia-zole.

Project description:In the title compound, C(24)H(21)N(3)OS, the pyrazole ring makes dihedral angles of 5.40 (7) and 6.72 (8)° with the benzo[d]thiazole ring system and the benzene ring, respectively, and a dihedral angle of 85.72 (8)° with the meth-oxy-substituted benzene ring. In the crystal structure, the mol-ecules are linked by C-H⋯π inter-actions.

| S-EPMC3200767 | biostudies-literature

2-Amino-6-methyl-1,3-benzothia-zole-deca-nedioic acid (2/1).

Project description:Co-crystallization of 2-amino-6-methyl-1,3--benzothia-zole with deca-nedioic acid under hydro-thermal conditions afforded the title 2:1 co-crystal, 2C(8)H(8)N(2)S·C(10)H(18)O(4). The deca-nedioic acid mol-ecule is located on an inversion centre. In the crystal, inter-molecular N-H?O and O-H?O hydrogen bonds connect the components into a two-dimensional wave-like layer structure extending parallel to (100).

| S-EPMC2970063 | biostudies-literature

2-Hydrazinyl-4-methyl-1,3-benzothia-zole.

Project description:The title compound, C(8)H(9)N(3)S, is almost planar (r.m.s. deviation = 0.019?Å) apart from the terminal -NH(2) grouping [deviation of the N atom = 0.286?(2)?Å]. In the crystal, mol-ecules are linked by N-H?N hydrogen bonds, generating (001) sheets.

| S-EPMC3152062 | biostudies-literature

OmicsDI is part of the ELIXIR infrastructure

OmicsDI is an Elixir interoperability service. Learn more ›

Tweets

OmicsDI Databases

PRIDE
PeptideAtlas
MassIVE
JPOST Repository
Physiome Model Repository

EGA
EVA
ENA
LINCS
PAXDB
Cell Collective

MetaboLights
Metabolomics Workbench
MetabolomeExpress
GNPS
BioModels
FAIRDOMHub

ArrayExpress
dbGaP
ExpressionAtlas
GEO
NODE

Information

Databases
Help
API
Contact us
Code on GitHub
Terms of use
Submit Data