2-(3-ethylimidazol-4-yl)-N-methyl-1-(2-methylpropyl)-N-(2-sulfanylphenyl)-2,3-dihydro-1-benzazepine-4-carboxamide

Systemtic Name: 2-(3-ethylimidazol-4-yl)-N-methyl-1-(2-methylpropyl)-N-(2-sulfanylphenyl)-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: 2-(3-ethylimidazol-4-yl)-1-isobutyl-N-methyl-N-(2-sulfanylphenyl)-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: 2-(3-ethyl-4-imidazolyl)-N-(2-mercaptophenyl)-N-methyl-1-(2-methylpropyl)-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: 2-(3-ethylimidazol-4-yl)-N-methyl-1-(2-methylpropyl)-N-(2-sulfanylphenyl)-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: 2-(3-ethylimidazol-4-yl)-1-isobutyl-N-(2-mercaptophenyl)-N-methyl-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C27H32N4OS MolecularWeight: 460.63418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC=C1C2CC(=CC3=CC=CC=C3N2CC(C)C)C(=O)N(C)C4=CC=CC=C4S

Isomeric SMILES

CCN1C=NC=C1C2CC(=CC3=CC=CC=C3N2CC(C)C)C(=O)N(C)C4=CC=CC=C4S

InChI

InChI=1S/C27H32N4OS/c1-5-30-18-28-16-25(30)24-15-21(27(32)29(4)23-12-8-9-13-26(23)33)14-20-10-6-7-11-22(20)31(24)17-19(2)3/h6-14,16,18-19,24,33H,5,15,17H2,1-4H3