(3S)-3-(1H-benzimidazol-2-yl)-3-cyano-4-(2-methoxyphenyl)-N-phenyl-butanamide

Systemtic Name: (3S)-3-(1H-benzimidazol-2-yl)-3-cyano-4-(2-methoxyphenyl)-N-phenyl-butanamide Openeye Name: (3S)-3-(1H-benzimidazol-2-yl)-3-cyano-4-(2-methoxyphenyl)-N-phenyl-butanamide CAS Name: (3S)-3-(1H-benzimidazol-2-yl)-3-cyano-4-(2-methoxyphenyl)-N-phenylbutanamide IUPAC Name: (3S)-3-(1H-benzimidazol-2-yl)-3-cyano-4-(2-methoxyphenyl)-N-phenylbutanamide Traditional Name: (3S)-3-(1H-benzimidazol-2-yl)-3-cyano-4-(2-methoxyphenyl)-N-phenyl-butyramide Formula: C25H22N4O2 MolecularWeight: 410.46778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CC(CC(=O)NC2=CC=CC=C2)(C#N)C3=NC4=CC=CC=C4N3

Isomeric SMILES

COC1=CC=CC=C1C[C@](CC(=O)NC2=CC=CC=C2)(C#N)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C25H22N4O2/c1-31-22-14-8-5-9-18(22)15-25(17-26,16-23(30)27-19-10-3-2-4-11-19)24-28-20-12-6-7-13-21(20)29-24/h2-14H,15-16H2,1H3,(H,27,30)(H,28,29)/t25-/m0/s1