4-(2-bromanyl-4-methyl-phenyl)-5-methyl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(2-bromanyl-4-methyl-phenyl)-5-methyl-1,2,4-triazole-3-thiolate Openeye Name: 4-(2-bromo-4-methyl-phenyl)-5-methyl-1,2,4-triazole-3-thiolate CAS Name: 4-(2-bromo-4-methylphenyl)-5-methyl-1,2,4-triazole-3-thiolate IUPAC Name: 4-(2-bromo-4-methylphenyl)-5-methyl-1,2,4-triazole-3-thiolate Traditional Name: 4-(2-bromo-4-methyl-phenyl)-5-methyl-1,2,4-triazole-3-thiolate Formula: C10H9BrN3S- MolecularWeight: 283.16756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=NN=C2[S-])C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=NN=C2[S-])C)Br

InChI

InChI=1S/C10H10BrN3S/c1-6-3-4-9(8(11)5-6)14-7(2)12-13-10(14)15/h3-5H,1-2H3,(H,13,15)/p-1