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

Systemtic Name: 2-(1-butan-2-ylimidazol-2-yl)-N-methyl-1-(2-methylpropyl)-N-(2-sulfanylphenyl)-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: 1-isobutyl-N-methyl-2-(1-sec-butylimidazol-2-yl)-N-(2-sulfanylphenyl)-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: 2-(1-butan-2-yl-2-imidazolyl)-N-(2-mercaptophenyl)-N-methyl-1-(2-methylpropyl)-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: 2-(1-butan-2-ylimidazol-2-yl)-N-methyl-1-(2-methylpropyl)-N-(2-sulfanylphenyl)-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: 1-isobutyl-N-(2-mercaptophenyl)-N-methyl-2-(1-sec-butylimidazol-2-yl)-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C29H36N4OS MolecularWeight: 488.68734

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=CN=C1C2CC(=CC3=CC=CC=C3N2CC(C)C)C(=O)N(C)C4=CC=CC=C4S

Isomeric SMILES

CCC(C)N1C=CN=C1C2CC(=CC3=CC=CC=C3N2CC(C)C)C(=O)N(C)C4=CC=CC=C4S

InChI

InChI=1S/C29H36N4OS/c1-6-21(4)32-16-15-30-28(32)26-18-23(29(34)31(5)25-13-9-10-14-27(25)35)17-22-11-7-8-12-24(22)33(26)19-20(2)3/h7-17,20-21,26,35H,6,18-19H2,1-5H3