2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-pentan-2-yl-ethanamide

Systemtic Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-pentan-2-yl-ethanamide Openeye Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(1-methylbutyl)acetamide CAS Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-pentan-2-ylacetamide IUPAC Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-pentan-2-ylacetamide Traditional Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(1-methylbutyl)acetamide Formula: C22H24N4OS MolecularWeight: 392.51716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)CSC1=NC(=C(N=N1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCC(C)NC(=O)CSC1=NC(=C(N=N1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H24N4OS/c1-3-10-16(2)23-19(27)15-28-22-24-20(17-11-6-4-7-12-17)21(25-26-22)18-13-8-5-9-14-18/h4-9,11-14,16H,3,10,15H2,1-2H3,(H,23,27)