2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide

Systemtic Name: 2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide Openeye Name: 2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide CAS Name: 2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)thio]-N-phenylpropanamide IUPAC Name: 2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylpropanamide Traditional Name: 2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)thio]-N-phenyl-propionamide Formula: C20H22N4OS MolecularWeight: 366.47988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CCC2=CC=CC=C2)SC(C)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=NN=C(N1CCC2=CC=CC=C2)SC(C)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H22N4OS/c1-15(19(25)21-18-11-7-4-8-12-18)26-20-23-22-16(2)24(20)14-13-17-9-5-3-6-10-17/h3-12,15H,13-14H2,1-2H3,(H,21,25)