4-(1H-benzimidazol-2-ylsulfanyl)-N-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-butanamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-butanamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(4-methoxyanilino)-2-oxo-ethyl]-N-methyl-butanamide CAS Name: 4-(1H-benzimidazol-2-ylthio)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbutanamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbutanamide Traditional Name: 4-(1H-benzimidazol-2-ylthio)-N-[2-keto-2-(p-anisidino)ethyl]-N-methyl-butyramide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=C(C=C1)OC)C(=O)CCCSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CN(CC(=O)NC1=CC=C(C=C1)OC)C(=O)CCCSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C21H24N4O3S/c1-25(14-19(26)22-15-9-11-16(28-2)12-10-15)20(27)8-5-13-29-21-23-17-6-3-4-7-18(17)24-21/h3-4,6-7,9-12H,5,8,13-14H2,1-2H3,(H,22,26)(H,23,24)