N,N-diphenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide

Systemtic Name: N,N-diphenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide Openeye Name: N,N-diphenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide CAS Name: N,N-diphenyl-2-(1H-1,2,4-triazol-5-ylthio)butanamide IUPAC Name: N,N-diphenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide Traditional Name: N,N-diphenyl-2-(1H-1,2,4-triazol-5-ylthio)butyramide Formula: C18H18N4OS MolecularWeight: 338.42672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NC=NN3

Isomeric SMILES

CCC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NC=NN3

InChI

InChI=1S/C18H18N4OS/c1-2-16(24-18-19-13-20-21-18)17(23)22(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13,16H,2H2,1H3,(H,19,20,21)