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

Systemtic Name: N-[4-[(4-methyl-1,2,4-triazol-3-yl)methylsulfanyl]phenyl]-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: N-[4-[(4-methyl-1,2,4-triazol-3-yl)methylsulfanyl]phenyl]-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: N-[4-[(4-methyl-1,2,4-triazol-3-yl)methylthio]phenyl]-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: N-[4-[(4-methyl-1,2,4-triazol-3-yl)methylsulfanyl]phenyl]-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: N-[4-[(4-methyl-1,2,4-triazol-3-yl)methylthio]phenyl]-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C24H27N5OS MolecularWeight: 433.56908

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(=CC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)SCC4=NN=CN4C

Isomeric SMILES

CCCN1CCC(=CC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)SCC4=NN=CN4C

InChI

InChI=1S/C24H27N5OS/c1-3-13-29-14-12-19(15-18-6-4-5-7-22(18)29)24(30)26-20-8-10-21(11-9-20)31-16-23-27-25-17-28(23)2/h4-11,15,17H,3,12-14,16H2,1-2H3,(H,26,30)