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

Systemtic Name: N-[(2-methylpyrazol-3-yl)methylsulfinyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-[(2-methylpyrazol-3-yl)methylsulfinyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-[(2-methyl-3-pyrazolyl)methylsulfinyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-[(2-methylpyrazol-3-yl)methylsulfinyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-[(2-methylpyrazol-3-yl)methylsulfinyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)CS(=O)N(C2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4NCC3

Isomeric SMILES

CN1C(=CC=N1)CS(=O)N(C2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4NCC3

InChI

InChI=1S/C22H22N4O2S/c1-25-20(12-14-24-25)16-29(28)26(19-8-3-2-4-9-19)22(27)18-11-13-23-21-10-6-5-7-17(21)15-18/h2-10,12,14-15,23H,11,13,16H2,1H3