2-(1-cyclopropylimidazol-2-yl)-1-(2-methylpropyl)-N-methylsulfinyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide

Systemtic Name: 2-(1-cyclopropylimidazol-2-yl)-1-(2-methylpropyl)-N-methylsulfinyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: 2-(1-cyclopropylimidazol-2-yl)-1-isobutyl-N-methylsulfinyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: 2-(1-cyclopropyl-2-imidazolyl)-1-(2-methylpropyl)-N-methylsulfinyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: 2-(1-cyclopropylimidazol-2-yl)-1-(2-methylpropyl)-N-methylsulfinyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: 2-(1-cyclopropylimidazol-2-yl)-1-isobutyl-N-methylsulfinyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C28H32N4O2S MolecularWeight: 488.64428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(CC(=CC2=CC=CC=C21)C(=O)N(C3=CC=CC=C3)S(=O)C)C4=NC=CN4C5CC5

Isomeric SMILES

CC(C)CN1C(CC(=CC2=CC=CC=C21)C(=O)N(C3=CC=CC=C3)S(=O)C)C4=NC=CN4C5CC5

InChI

InChI=1S/C28H32N4O2S/c1-20(2)19-31-25-12-8-7-9-21(25)17-22(18-26(31)27-29-15-16-30(27)23-13-14-23)28(33)32(35(3)34)24-10-5-4-6-11-24/h4-12,15-17,20,23,26H,13-14,18-19H2,1-3H3