3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-4-(3-chlorophenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-4-(3-chlorophenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-4-(3-chlorophenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-4-(3-chlorophenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-4-(3-chlorophenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-4-(3-chlorophenyl)-1H-1,2,4-triazole-5-thione Formula: C14H13BrClN5S MolecularWeight: 398.70852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=NNC(=S)N2C3=CC(=CC=C3)Cl)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=NNC(=S)N2C3=CC(=CC=C3)Cl)C)Br

InChI

InChI=1S/C14H13BrClN5S/c1-8-13(15)9(2)20(19-8)7-12-17-18-14(22)21(12)11-5-3-4-10(16)6-11/h3-6H,7H2,1-2H3,(H,18,22)