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

Systemtic Name: N-[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl]-4-(1H-benzimidazol-2-ylsulfanyl)-N-ethyl-butanamide Openeye Name: N-[2-(4-acetamidoanilino)-2-oxo-ethyl]-4-(1H-benzimidazol-2-ylsulfanyl)-N-ethyl-butanamide CAS Name: N-[2-(4-acetamidoanilino)-2-oxoethyl]-4-(1H-benzimidazol-2-ylthio)-N-ethylbutanamide IUPAC Name: N-[2-(4-acetamidoanilino)-2-oxoethyl]-4-(1H-benzimidazol-2-ylsulfanyl)-N-ethylbutanamide Traditional Name: N-[2-(4-acetamidoanilino)-2-keto-ethyl]-4-(1H-benzimidazol-2-ylthio)-N-ethyl-butyramide Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC=C(C=C1)NC(=O)C)C(=O)CCCSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCN(CC(=O)NC1=CC=C(C=C1)NC(=O)C)C(=O)CCCSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C23H27N5O3S/c1-3-28(15-21(30)25-18-12-10-17(11-13-18)24-16(2)29)22(31)9-6-14-32-23-26-19-7-4-5-8-20(19)27-23/h4-5,7-8,10-13H,3,6,9,14-15H2,1-2H3,(H,24,29)(H,25,30)(H,26,27)