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

Systemtic Name: N-[(3-methylimidazol-4-yl)methylsulfanyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-[(3-methylimidazol-4-yl)methylsulfanyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-[(3-methyl-4-imidazolyl)methylthio]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-[(3-methylimidazol-4-yl)methylsulfanyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-[(3-methylimidazol-4-yl)methylthio]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1CSN(C2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4NCC3

Isomeric SMILES

CN1C=NC=C1CSN(C2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4NCC3

InChI

InChI=1S/C22H22N4OS/c1-25-16-23-14-20(25)15-28-26(19-8-3-2-4-9-19)22(27)18-11-12-24-21-10-6-5-7-17(21)13-18/h2-10,13-14,16,24H,11-12,15H2,1H3