N-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)-1-(4-methylsulfanylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)-1-(4-methylsulfanylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)-1-(4-methylsulfanylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(1,3-dimethyl-2-oxo-5-benzimidazolyl)-1-[4-(methylthio)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-1-(4-methylsulfanylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-keto-1,3-dimethyl-benzimidazol-5-yl)-1-[4-(methylthio)phenyl]sulfonyl-isonipecotamide Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)SC)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)SC)N(C1=O)C

InChI

InChI=1S/C22H26N4O4S2/c1-24-19-9-4-16(14-20(19)25(2)22(24)28)23-21(27)15-10-12-26(13-11-15)32(29,30)18-7-5-17(31-3)6-8-18/h4-9,14-15H,10-13H2,1-3H3,(H,23,27)