6-methyl-4-[(Z)-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one

Systemtic Name: 6-methyl-4-[(Z)-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one Openeye Name: 6-methyl-4-[(Z)-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]methyleneamino]-3-thioxo-2H-1,2,4-triazin-5-one CAS Name: 6-methyl-4-[(Z)-[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one IUPAC Name: 6-methyl-4-[(Z)-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]methylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one Traditional Name: 6-methyl-4-[(Z)-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]methyleneamino]-3-thioxo-2H-1,2,4-triazin-5-one Formula: C21H18N6OS MolecularWeight: 402.47222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C=NN3C(=O)C(=NNC3=S)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2/C=N\N3C(=O)C(=NNC3=S)C)C4=CC=CC=C4

InChI

InChI=1S/C21H18N6OS/c1-14-8-10-16(11-9-14)19-17(13-26(25-19)18-6-4-3-5-7-18)12-22-27-20(28)15(2)23-24-21(27)29/h3-13H,1-2H3,(H,24,29)/b22-12-