4-(4-chlorophenyl)-3-(1,3-dimethylpyrazol-4-yl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(4-chlorophenyl)-3-(1,3-dimethylpyrazol-4-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-chlorophenyl)-3-(1,3-dimethylpyrazol-4-yl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(4-chlorophenyl)-3-(1,3-dimethyl-4-pyrazolyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(4-chlorophenyl)-3-(1,3-dimethylpyrazol-4-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-chlorophenyl)-3-(1,3-dimethylpyrazol-4-yl)-1H-1,2,4-triazole-5-thione Formula: C13H12ClN5S MolecularWeight: 305.78588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2=NNC(=S)N2C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=NN(C=C1C2=NNC(=S)N2C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C13H12ClN5S/c1-8-11(7-18(2)17-8)12-15-16-13(20)19(12)10-5-3-9(14)4-6-10/h3-7H,1-2H3,(H,16,20)