4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-(3-fluorophenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-(3-fluorophenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-(3-fluorophenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylideneamino]-3-(3-fluorophenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]-3-(3-fluorophenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-(3-fluorophenyl)-1H-1,2,4-triazole-5-thione Formula: C20H17FN6S MolecularWeight: 392.452583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=NN3C(=NNC3=S)C4=CC(=CC=C4)F

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C=NN3C(=NNC3=S)C4=CC(=CC=C4)F

InChI

InChI=1S/C20H17FN6S/c1-13-18(14(2)26(25-13)17-9-4-3-5-10-17)12-22-27-19(23-24-20(27)28)15-7-6-8-16(21)11-15/h3-12H,1-2H3,(H,24,28)