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

Systemtic Name: 2-[[6-(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)butanamide Openeye Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-2-[[6-(p-tolyl)-1,2,4-triazin-3-yl]sulfanyl]butanamide CAS Name: 2-[[6-(4-methylphenyl)-1,2,4-triazin-3-yl]thio]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)butanamide IUPAC Name: 2-[[6-(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)butanamide Traditional Name: N-(5-keto-1-phenyl-3-pyrazolin-3-yl)-2-[[6-(p-tolyl)-1,2,4-triazin-3-yl]thio]butyramide Formula: C23H22N6O2S MolecularWeight: 446.52478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N6O2S/c1-3-19(32-23-24-14-18(26-27-23)16-11-9-15(2)10-12-16)22(31)25-20-13-21(30)29(28-20)17-7-5-4-6-8-17/h4-14,19,28H,3H2,1-2H3,(H,25,31)