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3-Acetyl-1-(2,6-dimethyl-phen-yl)thio-urea.

ABSTRACT: In the title compound, C(11)H(14)N(2)OS, the two N-H bonds are anti to each other and one of them is anti to the C=S and the other is syn. Further, the amide C=S and the C=O groups are anti to each other. The dihedral angle between the benzene ring and the side chain is 83.74?(5)°. An intra-molecular N-H?O hydrogen bond occurs. In the crystal, mol-ecules are linked into inversion dimers by pairs of N-H?S inter-actions.

SUBMITTER: Kumar S

PROVIDER: S-EPMC3414176 | biostudies-literature | 2012 Aug

REPOSITORIES: biostudies-literature

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3-Acetyl-1-(2,6-dimethyl-phen-yl)thio-urea.

Kumar Sharatha S Foro Sabine S Gowda B Thimme BT

Acta crystallographica. Section E, Structure reports online 20120704 Pt 8

In the title compound, C(11)H(14)N(2)OS, the two N-H bonds are anti to each other and one of them is anti to the C=S and the other is syn. Further, the amide C=S and the C=O groups are anti to each other. The dihedral angle between the benzene ring and the side chain is 83.74 (5)°. An intra-molecular N-H⋯O hydrogen bond occurs. In the crystal, mol-ecules are linked into inversion dimers by pairs of N-H⋯S inter-actions. ...[more]

PMID: 22904783

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