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

Systemtic Name: N-[(4-ethoxypyridin-2-yl)methylsulfinyl]-1-(2-methylpropyl)-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: N-[(4-ethoxy-2-pyridyl)methylsulfinyl]-1-isobutyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: N-[(4-ethoxy-2-pyridinyl)methylsulfinyl]-1-(2-methylpropyl)-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: N-[(4-ethoxypyridin-2-yl)methylsulfinyl]-1-(2-methylpropyl)-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: N-[(4-ethoxy-2-pyridyl)methylsulfinyl]-1-isobutyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C29H33N3O3S MolecularWeight: 503.65562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=NC=C1)CS(=O)N(C2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4N(CC3)CC(C)C

Isomeric SMILES

CCOC1=CC(=NC=C1)CS(=O)N(C2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4N(CC3)CC(C)C

InChI

InChI=1S/C29H33N3O3S/c1-4-35-27-14-16-30-25(19-27)21-36(34)32(26-11-6-5-7-12-26)29(33)24-15-17-31(20-22(2)3)28-13-9-8-10-23(28)18-24/h5-14,16,18-19,22H,4,15,17,20-21H2,1-3H3