N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-(3,4-dimethylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-(3,4-dimethylphenyl)-4-oxidanylidene-butanamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-(3,4-dimethylphenyl)-4-oxo-butanamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-4-(3,4-dimethylphenyl)-4-oxobutanamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-4-(3,4-dimethylphenyl)-4-oxobutanamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-(3,4-dimethylphenyl)-4-keto-butyramide Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CCC(=O)NC(CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CCC(=O)N[C@@H](CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3)C

InChI

InChI=1S/C27H27N3O2/c1-18-12-13-21(16-19(18)2)25(31)14-15-26(32)28-24(17-20-8-4-3-5-9-20)27-29-22-10-6-7-11-23(22)30-27/h3-13,16,24H,14-15,17H2,1-2H3,(H,28,32)(H,29,30)/t24-/m0/s1