Unknown

Dataset Information

0

N-{(2S)-3-Hy-droxy-4-[(5-methyl-1,3,4-thia-diazol-2-yl)sulfan-yl]-1-phenyl-2-but-yl}-4-methyl-benzene-sulfonamide.

ABSTRACT: The thia-diazoyl and sulfonyl-benzene rings in the title compound, C(20)H(23)N(3)O(3)S(3), are aligned to the same side of the mol-ecule, forming a twisted 'U' shape [dihedral angle = 77.6?(5)°]. The benzyl-benzene ring is orientated in the opposite direction from the mol-ecule but projects approximately along the same axis as the other rings [dihedral angle between benzene rings = 28.2?(5)°] so that, overall, the mol-ecule has a flattened shape. The hy-droxy and amine groups are almost syn which enables the formation of inter-molecular hy-droxy-OH?N(thia-diazo-yl) and amine-H?O(sulfon-yl) hydrogen bonds leading to a supra-molecular chain aligned along the a axis.

SUBMITTER: Gomes CR 

PROVIDER: S-EPMC3200695 | biostudies-literature | 2011 Sep

REPOSITORIES: biostudies-literature

Json Xml
altmetric image

Publications

N-{(2S)-3-Hy-droxy-4-[(5-methyl-1,3,4-thia-diazol-2-yl)sulfan-yl]-1-phenyl-2-but-yl}-4-methyl-benzene-sulfonamide.

Gomes Claudia R B CR   Vasconcelos Thatyana R A TR   Junior Walcimar T Vellasco WT   Cunico Wilson W   Wardell James L JL   Wardell Solange M S V SM   Tiekink Edward R T ER  

Acta crystallographica. Section E, Structure reports online 20110827 Pt 9

The thia-diazoyl and sulfonyl-benzene rings in the title compound, C(20)H(23)N(3)O(3)S(3), are aligned to the same side of the mol-ecule, forming a twisted 'U' shape [dihedral angle = 77.6 (5)°]. The benzyl-benzene ring is orientated in the opposite direction from the mol-ecule but projects approximately along the same axis as the other rings [dihedral angle between benzene rings = 28.2 (5)°] so that, overall, the mol-ecule has a flattened shape. The hy-droxy and amine groups are almost syn whic  ...[more]

Similar Datasets

Unknown 5-({3-[(5-Amino-1,3,4-thia-diazol-2-yl)sulfanylmeth-yl]benz-yl}sulfan-yl)-1,3,4-thia-diazol-2-amine.
| S-EPMC3344171 | biostudies-literature
Unknown Bis[(5-phenyl-1,3,4-thia-diazol-2-yl)sulfan-yl]methane.
| S-EPMC3011391 | biostudies-literature
Unknown 1,4-Bis[(5-phenyl-1,3,4-thia-diazol-2-yl)sulfan-yl]butane.
| S-EPMC3052050 | biostudies-literature
Unknown 2-(4-Methyl-phen-yl)-5-[({[5-(4-methyl-phen-yl)-1,3,4-thia-diazol-2-yl]sulfan-yl}meth-yl)sulfan-yl]-1,3,4-thia-diazole.
| S-EPMC3297906 | biostudies-other
Unknown 3,5-Dimethyl-1-{2-[(5-methyl-1,3,4-thia-diazol-2-yl)sulfan-yl]acet-yl}-2,6-diphenylpiperidin-4-one.
| S-EPMC3684930 | biostudies-literature
Unknown (S)-N-[1-(5-Benzyl-sulfan-yl-1,3,4-oxa-diazol-2-yl)-2-phenyl-eth-yl]-4-methyl-benzene-sulfonamide.
| S-EPMC3247610 | biostudies-literature
Unknown 5-(2-Methyl-phen-yl)-1,3,4-thia-diazol-2-amine.
| S-EPMC2977661 | biostudies-literature
Unknown N-(5-Methyl-sulfanyl-1,3,4-thia-diazol-2-yl)acetamide.
| S-EPMC2969935 | biostudies-literature
Unknown N'-[(E)-2-Chloro-benzyl-idene]-2-[(1,3,4-thia-diazol-2-yl)sulfan-yl]acetohydrazide.
| S-EPMC3201361 | biostudies-literature
Unknown 5,5'-[Methyl-enebis(sulfanedi-yl)]bis-(1,3,4-thia-diazol-2-amine).
| S-EPMC2959241 | biostudies-literature