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

Systemtic Name: 3-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(3-methylphenyl)propanamide Openeye Name: 3-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(m-tolyl)propanamide CAS Name: 3-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(3-methylphenyl)propanamide IUPAC Name: 3-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(3-methylphenyl)propanamide Traditional Name: 3-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(m-tolyl)propionamide Formula: C25H22N4OS MolecularWeight: 426.53338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CCSC2=NC(=C(N=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CCSC2=NC(=C(N=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N4OS/c1-18-9-8-14-21(17-18)26-22(30)15-16-31-25-27-23(19-10-4-2-5-11-19)24(28-29-25)20-12-6-3-7-13-20/h2-14,17H,15-16H2,1H3,(H,26,30)