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

Systemtic Name: 2-(1H-imidazol-2-yl)-N-methyl-1-(2-methylpropyl)-N-(2-sulfanylphenyl)-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: 2-(1H-imidazol-2-yl)-1-isobutyl-N-methyl-N-(2-sulfanylphenyl)-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: 2-(1H-imidazol-2-yl)-N-(2-mercaptophenyl)-N-methyl-1-(2-methylpropyl)-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: 2-(1H-imidazol-2-yl)-N-methyl-1-(2-methylpropyl)-N-(2-sulfanylphenyl)-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: 2-(1H-imidazol-2-yl)-1-isobutyl-N-(2-mercaptophenyl)-N-methyl-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C25H28N4OS MolecularWeight: 432.58102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(CC(=CC2=CC=CC=C21)C(=O)N(C)C3=CC=CC=C3S)C4=NC=CN4

Isomeric SMILES

CC(C)CN1C(CC(=CC2=CC=CC=C21)C(=O)N(C)C3=CC=CC=C3S)C4=NC=CN4

InChI

InChI=1S/C25H28N4OS/c1-17(2)16-29-20-9-5-4-8-18(20)14-19(15-22(29)24-26-12-13-27-24)25(30)28(3)21-10-6-7-11-23(21)31/h4-14,17,22,31H,15-16H2,1-3H3,(H,26,27)