2-cyano-4-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-3-oxidanylidene-N-(phenylmethyl)butanamide

Systemtic Name: 2-cyano-4-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-3-oxidanylidene-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-2-cyano-4-(1-isobutylbenzimidazol-2-yl)sulfanyl-3-oxo-butanamide CAS Name: 2-cyano-4-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]-3-oxo-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-2-cyano-4-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-3-oxobutanamide Traditional Name: N-benzyl-2-cyano-4-[(1-isobutylbenzimidazol-2-yl)thio]-3-keto-butyramide Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2N=C1SCC(=O)C(C#N)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2N=C1SCC(=O)C(C#N)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H24N4O2S/c1-16(2)14-27-20-11-7-6-10-19(20)26-23(27)30-15-21(28)18(12-24)22(29)25-13-17-8-4-3-5-9-17/h3-11,16,18H,13-15H2,1-2H3,(H,25,29)