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

Systemtic Name: 2-[[6-(4-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)butanamide Openeye Name: 2-[[6-(4-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)butanamide CAS Name: 2-[[6-(4-methoxyphenyl)-1,2,4-triazin-3-yl]thio]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)butanamide IUPAC Name: 2-[[6-(4-methoxyphenyl)-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-(4-methoxyphenyl)-1,2,4-triazin-3-yl]thio]butyramide Formula: C23H22N6O3S MolecularWeight: 462.52418

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C23H22N6O3S/c1-3-19(22(31)25-20-13-21(30)29(28-20)16-7-5-4-6-8-16)33-23-24-14-18(26-27-23)15-9-11-17(32-2)12-10-15/h4-14,19,28H,3H2,1-2H3,(H,25,31)