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

Systemtic Name: N-phenyl-N-(pyridin-4-ylmethylsulfinyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-phenyl-N-(4-pyridylmethylsulfinyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-phenyl-N-(pyridin-4-ylmethylsulfinyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-phenyl-N-(pyridin-4-ylmethylsulfinyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-phenyl-N-(4-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=NC=C4

Isomeric SMILES

C1CNC2=CC=CC=C2C=C1C(=O)N(C3=CC=CC=C3)S(=O)CC4=CC=NC=C4

InChI

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