N-phenyl-N-(pyridin-2-ylmethylsulfinyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide

Systemtic Name: N-phenyl-N-(pyridin-2-ylmethylsulfinyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-phenyl-N-(2-pyridylmethylsulfinyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-phenyl-N-(2-pyridinylmethylsulfinyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-phenyl-N-(pyridin-2-ylmethylsulfinyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-phenyl-N-(2-pyridylmethylsulfinyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=CC=CC=C2C=C1C(=O)N(C3=CC=CC=C3)S(=O)CC4=CC=CC=N4

Isomeric SMILES

C1CNC2=CC=CC=C2C=C1C(=O)N(C3=CC=CC=C3)S(=O)CC4=CC=CC=N4

InChI

InChI=1S/C23H21N3O2S/c27-23(19-13-15-25-22-12-5-4-8-18(22)16-19)26(21-10-2-1-3-11-21)29(28)17-20-9-6-7-14-24-20/h1-12,14,16,25H,13,15,17H2