N-(benzimidazol-1-yl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: N-(benzimidazol-1-yl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-(benzimidazol-1-yl)-4-methylsulfanyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-(1-benzimidazolyl)-2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-(benzimidazol-1-yl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-(benzimidazol-1-yl)-4-(methylthio)-2-(tosylamino)butyramide Formula: C19H22N4O3S2 MolecularWeight: 418.53298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NN2C=NC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NN2C=NC3=CC=CC=C32

InChI

InChI=1S/C19H22N4O3S2/c1-14-7-9-15(10-8-14)28(25,26)22-17(11-12-27-2)19(24)21-23-13-20-16-5-3-4-6-18(16)23/h3-10,13,17,22H,11-12H2,1-2H3,(H,21,24)