3-ethyl-4-[(Z)-[1-(2-methylphenyl)-3-phenyl-pyrazol-4-yl]methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-ethyl-4-[(Z)-[1-(2-methylphenyl)-3-phenyl-pyrazol-4-yl]methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-ethyl-4-[(Z)-[1-(o-tolyl)-3-phenyl-pyrazol-4-yl]methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-ethyl-4-[(Z)-[1-(2-methylphenyl)-3-phenyl-4-pyrazolyl]methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-ethyl-4-[(Z)-[1-(2-methylphenyl)-3-phenylpyrazol-4-yl]methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-ethyl-4-[(Z)-[1-(o-tolyl)-3-phenyl-pyrazol-4-yl]methyleneamino]-1H-1,2,4-triazole-5-thione Formula: C21H20N6S MolecularWeight: 388.4887

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1N=CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4C

Isomeric SMILES

CCC1=NNC(=S)N1/N=C\C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4C

InChI

InChI=1S/C21H20N6S/c1-3-19-23-24-21(28)27(19)22-13-17-14-26(18-12-8-7-9-15(18)2)25-20(17)16-10-5-4-6-11-16/h4-14H,3H2,1-2H3,(H,24,28)/b22-13-