3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(4-chlorophenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(4-chlorophenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(4-chlorophenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(4-chlorophenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(4-chlorophenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(5-tert-butyl-1H-pyrazol-3-yl)-4-(4-chlorophenyl)-1H-1,2,4-triazole-5-thione Formula: C15H16ClN5S MolecularWeight: 333.83904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)C2=NNC(=S)N2C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)C2=NNC(=S)N2C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H16ClN5S/c1-15(2,3)12-8-11(17-18-12)13-19-20-14(22)21(13)10-6-4-9(16)5-7-10/h4-8H,1-3H3,(H,17,18)(H,20,22)