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Benzyl N-[(Z)-(1-methyl-2-sulfanyl-propyl-idene)amino]-carbamodithio-ate.

ABSTRACT: The title compound, C(12)H(16)N(2)S(3), was obtained by the condensation reaction of S-benzyl dithio-carbazate and 3-mercaptobutan-2-one. The phenyl ring and thiol (SH) group are approximately perpendicular [S-C-C-C and N-C-C-S torsion angles = 67.8?(3) and 116.9?(2)°, respectively] to the rest of the mol-ecule. In the crystal, mol-ecules are linked by weak S-H?S and N-H?S hydrogen bonds, ?-? inter-actions between the benzene rings [centroid-centroid distance = 3.823?(2)?Å] and C-H?? inter-actions.

SUBMITTER: Break MK 

PROVIDER: S-EPMC3569240 | biostudies-literature | 2013 Feb

REPOSITORIES: biostudies-literature

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Benzyl N-[(Z)-(1-methyl-2-sulfanyl-propyl-idene)amino]-carbamodithio-ate.

Break Mohammed Khaled Bin MK   Mehta Sachin S   Tahir M Ibrahim M MI   Crouse Karen A KA   Khoo Teng-Jin TJ  

Acta crystallographica. Section E, Structure reports online 20130104 Pt 2

The title compound, C(12)H(16)N(2)S(3), was obtained by the condensation reaction of S-benzyl dithio-carbazate and 3-mercaptobutan-2-one. The phenyl ring and thiol (SH) group are approximately perpendicular [S-C-C-C and N-C-C-S torsion angles = 67.8 (3) and 116.9 (2)°, respectively] to the rest of the mol-ecule. In the crystal, mol-ecules are linked by weak S-H⋯S and N-H⋯S hydrogen bonds, π-π inter-actions between the benzene rings [centroid-centroid distance = 3.823 (2) Å] and C-H⋯π inter-actio  ...[more]

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