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

Systemtic Name: 6-methyl-4-[(Z)-[1-(2-methylphenyl)-3-phenyl-pyrazol-4-yl]methylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one Openeye Name: 6-methyl-4-[(Z)-[1-(o-tolyl)-3-phenyl-pyrazol-4-yl]methyleneamino]-3-thioxo-2H-1,2,4-triazin-5-one CAS Name: 6-methyl-4-[(Z)-[1-(2-methylphenyl)-3-phenyl-4-pyrazolyl]methylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one IUPAC Name: 6-methyl-4-[(Z)-[1-(2-methylphenyl)-3-phenylpyrazol-4-yl]methylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one Traditional Name: 6-methyl-4-[(Z)-[1-(o-tolyl)-3-phenyl-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=CC=C1N2C=C(C(=N2)C3=CC=CC=C3)C=NN4C(=O)C(=NNC4=S)C

Isomeric SMILES

CC1=CC=CC=C1N2C=C(C(=N2)C3=CC=CC=C3)/C=N\N4C(=O)C(=NNC4=S)C

InChI

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