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

Systemtic Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(1-methoxypropan-2-yl)ethanamide Openeye Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(2-methoxy-1-methyl-ethyl)acetamide CAS Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(1-methoxypropan-2-yl)acetamide IUPAC Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(1-methoxypropan-2-yl)acetamide Traditional Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(2-methoxy-1-methyl-ethyl)acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O2S/c1-15(13-27-2)22-18(26)14-28-21-23-19(16-9-5-3-6-10-16)20(24-25-21)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3,(H,22,26)