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

Systemtic Name: N-phenyl-N-(pyridin-2-ylsulfanylmethyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-phenyl-N-(2-pyridylsulfanylmethyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-phenyl-N-[(2-pyridinylthio)methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-phenyl-N-(pyridin-2-ylsulfanylmethyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-phenyl-N-[(2-pyridylthio)methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=CC=CC=C2C=C1C(=O)N(CSC3=CC=CC=N3)C4=CC=CC=C4

Isomeric SMILES

C1CNC2=CC=CC=C2C=C1C(=O)N(CSC3=CC=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3OS/c27-23(19-13-15-24-21-11-5-4-8-18(21)16-19)26(20-9-2-1-3-10-20)17-28-22-12-6-7-14-25-22/h1-12,14,16,24H,13,15,17H2