N-[[4-(2-methylpropyl)-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide

Systemtic Name: N-[[4-(2-methylpropyl)-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: N-[(4-isobutyl-1,2,4-triazol-3-yl)methylsulfanyl]-N-phenyl-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: N-[[4-(2-methylpropyl)-1,2,4-triazol-3-yl]methylthio]-N-phenyl-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: N-[[4-(2-methylpropyl)-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: N-[(4-isobutyl-1,2,4-triazol-3-yl)methylthio]-N-phenyl-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C27H33N5OS MolecularWeight: 475.64882

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(=CC2=CC=CC=C21)C(=O)N(C3=CC=CC=C3)SCC4=NN=CN4CC(C)C

Isomeric SMILES

CCCN1CCC(=CC2=CC=CC=C21)C(=O)N(C3=CC=CC=C3)SCC4=NN=CN4CC(C)C

InChI

InChI=1S/C27H33N5OS/c1-4-15-30-16-14-23(17-22-10-8-9-13-25(22)30)27(33)32(24-11-6-5-7-12-24)34-19-26-29-28-20-31(26)18-21(2)3/h5-13,17,20-21H,4,14-16,18-19H2,1-3H3