2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)propanamide

Systemtic Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)propanamide Openeye Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)propanamide CAS Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)propanamide IUPAC Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)propanamide Traditional Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(5-keto-1-phenyl-3-pyrazolin-3-yl)propionamide Formula: C27H22N6O2S MolecularWeight: 494.56758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=O)N(N1)C2=CC=CC=C2)SC3=NC(=C(N=N3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C(=O)NC1=CC(=O)N(N1)C2=CC=CC=C2)SC3=NC(=C(N=N3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H22N6O2S/c1-18(26(35)28-22-17-23(34)33(32-22)21-15-9-4-10-16-21)36-27-29-24(19-11-5-2-6-12-19)25(30-31-27)20-13-7-3-8-14-20/h2-18,32H,1H3,(H,28,35)