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

Systemtic Name: 3-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethyl]-4-(3-methylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)ethyl]-4-(m-tolyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[2-(4-bromo-3,5-dimethyl-1-pyrazolyl)ethyl]-4-(3-methylphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-4-(3-methylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)ethyl]-4-(m-tolyl)-1H-1,2,4-triazole-5-thione Formula: C16H18BrN5S MolecularWeight: 392.31662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NNC2=S)CCN3C(=C(C(=N3)C)Br)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NNC2=S)CCN3C(=C(C(=N3)C)Br)C

InChI

InChI=1S/C16H18BrN5S/c1-10-5-4-6-13(9-10)22-14(18-19-16(22)23)7-8-21-12(3)15(17)11(2)20-21/h4-6,9H,7-8H2,1-3H3,(H,19,23)