2-methoxy-N-[1-methyl-7-[(4S)-4-phenylazepan-1-yl]carbonyl-2-pyridin-4-yl-benzimidazol-5-yl]ethanamide

Systemtic Name: 2-methoxy-N-[1-methyl-7-[(4S)-4-phenylazepan-1-yl]carbonyl-2-pyridin-4-yl-benzimidazol-5-yl]ethanamide Openeye Name: 2-methoxy-N-[1-methyl-7-[(4S)-4-phenylazepane-1-carbonyl]-2-(4-pyridyl)benzimidazol-5-yl]acetamide CAS Name: 2-methoxy-N-[1-methyl-7-[oxo-[(4S)-4-phenyl-1-azepanyl]methyl]-2-pyridin-4-yl-5-benzimidazolyl]acetamide IUPAC Name: 2-methoxy-N-[1-methyl-7-[(4S)-4-phenylazepane-1-carbonyl]-2-pyridin-4-ylbenzimidazol-5-yl]acetamide Traditional Name: 2-methoxy-N-[1-methyl-7-[(4S)-4-phenylazepane-1-carbonyl]-2-(4-pyridyl)benzimidazol-5-yl]acetamide Formula: C29H31N5O3 MolecularWeight: 497.58814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2C(=O)N3CCCC(CC3)C4=CC=CC=C4)NC(=O)COC)N=C1C5=CC=NC=C5

Isomeric SMILES

CN1C2=C(C=C(C=C2C(=O)N3CCC[C@@H](CC3)C4=CC=CC=C4)NC(=O)COC)N=C1C5=CC=NC=C5

InChI

InChI=1S/C29H31N5O3/c1-33-27-24(29(36)34-15-6-9-21(12-16-34)20-7-4-3-5-8-20)17-23(31-26(35)19-37-2)18-25(27)32-28(33)22-10-13-30-14-11-22/h3-5,7-8,10-11,13-14,17-18,21H,6,9,12,15-16,19H2,1-2H3,(H,31,35)/t21-/m0/s1