2-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-propyl-ethanamide

Systemtic Name: 2-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-propyl-ethanamide Openeye Name: 2-[[5,6-bis(p-tolyl)-1,2,4-triazin-3-yl]sulfanyl]-N-propyl-acetamide CAS Name: 2-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]thio]-N-propylacetamide IUPAC Name: 2-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-propylacetamide Traditional Name: 2-[[5,6-bis(p-tolyl)-1,2,4-triazin-3-yl]thio]-N-propyl-acetamide Formula: C22H24N4OS MolecularWeight: 392.51716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4OS/c1-4-13-23-19(27)14-28-22-24-20(17-9-5-15(2)6-10-17)21(25-26-22)18-11-7-16(3)8-12-18/h5-12H,4,13-14H2,1-3H3,(H,23,27)