N-[(2-methoxypyridin-3-yl)methyl]-N-(2-sulfanylphenyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide

Systemtic Name: N-[(2-methoxypyridin-3-yl)methyl]-N-(2-sulfanylphenyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-[(2-methoxy-3-pyridyl)methyl]-N-(2-sulfanylphenyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-(2-mercaptophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-[(2-methoxypyridin-3-yl)methyl]-N-(2-sulfanylphenyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-(2-mercaptophenyl)-N-[(2-methoxy-3-pyridyl)methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C24H23N3O2S MolecularWeight: 417.52332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)CN(C2=CC=CC=C2S)C(=O)C3=CC4=CC=CC=C4NCC3

Isomeric SMILES

COC1=C(C=CC=N1)CN(C2=CC=CC=C2S)C(=O)C3=CC4=CC=CC=C4NCC3

InChI

InChI=1S/C24H23N3O2S/c1-29-23-19(8-6-13-26-23)16-27(21-10-4-5-11-22(21)30)24(28)18-12-14-25-20-9-3-2-7-17(20)15-18/h2-11,13,15,25,30H,12,14,16H2,1H3