4-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)sulfonyl-N-methyl-piperazine-1-carbothioamide

Systemtic Name: 4-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)sulfonyl-N-methyl-piperazine-1-carbothioamide Openeye Name: 4-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)sulfonyl-N-methyl-piperazine-1-carbothioamide CAS Name: 4-[(1,3-dimethyl-2-oxo-5-benzimidazolyl)sulfonyl]-N-methyl-1-piperazinecarbothioamide IUPAC Name: 4-(1,3-dimethyl-2-oxobenzimidazol-5-yl)sulfonyl-N-methylpiperazine-1-carbothioamide Traditional Name: 4-(2-keto-1,3-dimethyl-benzimidazol-5-yl)sulfonyl-N-methyl-piperazine-1-carbothioamide Formula: C15H21N5O3S2 MolecularWeight: 383.48894

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N3C)C

Isomeric SMILES

CNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N3C)C

InChI

InChI=1S/C15H21N5O3S2/c1-16-14(24)19-6-8-20(9-7-19)25(22,23)11-4-5-12-13(10-11)18(3)15(21)17(12)2/h4-5,10H,6-9H2,1-3H3,(H,16,24)