(3S)-2-(2-methyl-1-phenyl-benzimidazol-5-yl)carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3S)-2-(2-methyl-1-phenyl-benzimidazol-5-yl)carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3S)-2-(2-methyl-1-phenyl-benzimidazole-5-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3S)-2-[(2-methyl-1-phenyl-5-benzimidazolyl)-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3S)-2-(2-methyl-1-phenylbenzimidazole-5-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3S)-2-(2-methyl-1-phenyl-benzimidazole-5-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C25H22N4O2 MolecularWeight: 410.46778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)N4CC5=CC=CC=C5CC4C(=O)N

Isomeric SMILES

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)N4CC5=CC=CC=C5C[C@H]4C(=O)N

InChI

InChI=1S/C25H22N4O2/c1-16-27-21-13-18(11-12-22(21)29(16)20-9-3-2-4-10-20)25(31)28-15-19-8-6-5-7-17(19)14-23(28)24(26)30/h2-13,23H,14-15H2,1H3,(H2,26,30)/t23-/m0/s1