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

Systemtic Name: 3-ethyl-4-[(Z)-[3-(3-methylphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-ethyl-4-[(Z)-[3-(m-tolyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-ethyl-4-[(Z)-[3-(3-methylphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-ethyl-4-[(Z)-[3-(3-methylphenyl)-1-phenylpyrazol-4-yl]methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-ethyl-4-[(Z)-[3-(m-tolyl)-1-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)C)C4=CC=CC=C4

Isomeric SMILES

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

InChI

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