5-[(2R)-1-(4-bromanylpyrazol-1-yl)propan-2-yl]-4-(2-methylphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(2R)-1-(4-bromanylpyrazol-1-yl)propan-2-yl]-4-(2-methylphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-[(1R)-2-(4-bromopyrazol-1-yl)-1-methyl-ethyl]-4-(o-tolyl)-1,2,4-triazole-3-thiolate CAS Name: 5-[(2R)-1-(4-bromo-1-pyrazolyl)propan-2-yl]-4-(2-methylphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(2R)-1-(4-bromopyrazol-1-yl)propan-2-yl]-4-(2-methylphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-[(1R)-2-(4-bromopyrazol-1-yl)-1-methyl-ethyl]-4-(o-tolyl)-1,2,4-triazole-3-thiolate Formula: C15H15BrN5S- MolecularWeight: 377.2821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2[S-])C(C)CN3C=C(C=N3)Br

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2[S-])[C@H](C)CN3C=C(C=N3)Br

InChI

InChI=1S/C15H16BrN5S/c1-10-5-3-4-6-13(10)21-14(18-19-15(21)22)11(2)8-20-9-12(16)7-17-20/h3-7,9,11H,8H2,1-2H3,(H,19,22)/p-1/t11-/m1/s1