4-(3-bromanyl-4-methyl-phenyl)-3-(1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(3-bromanyl-4-methyl-phenyl)-3-(1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(3-bromo-4-methyl-phenyl)-3-(1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(3-bromo-4-methylphenyl)-3-(1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(3-bromo-4-methylphenyl)-3-(1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(3-bromo-4-methyl-phenyl)-3-(1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione Formula: C12H10BrN5S MolecularWeight: 336.2103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=NNC2=S)C3=CC=NN3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=NNC2=S)C3=CC=NN3)Br

InChI

InChI=1S/C12H10BrN5S/c1-7-2-3-8(6-9(7)13)18-11(16-17-12(18)19)10-4-5-14-15-10/h2-6H,1H3,(H,14,15)(H,17,19)