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

Systemtic Name: N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)-2-[(6-phenyl-1,2,4-triazin-3-yl)sulfanyl]butanamide Openeye Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-2-[(6-phenyl-1,2,4-triazin-3-yl)sulfanyl]butanamide CAS Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-2-[(6-phenyl-1,2,4-triazin-3-yl)thio]butanamide IUPAC Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-2-[(6-phenyl-1,2,4-triazin-3-yl)sulfanyl]butanamide Traditional Name: N-(5-keto-1-phenyl-3-pyrazolin-3-yl)-2-[(6-phenyl-1,2,4-triazin-3-yl)thio]butyramide Formula: C22H20N6O2S MolecularWeight: 432.4982

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C22H20N6O2S/c1-2-18(31-22-23-14-17(25-26-22)15-9-5-3-6-10-15)21(30)24-19-13-20(29)28(27-19)16-11-7-4-8-12-16/h3-14,18,27H,2H2,1H3,(H,24,30)