4-(2-bromophenyl)-5-propan-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(2-bromophenyl)-5-propan-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-(2-bromophenyl)-5-isopropyl-1,2,4-triazole-3-thiolate CAS Name: 4-(2-bromophenyl)-5-propan-2-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-(2-bromophenyl)-5-propan-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-(2-bromophenyl)-5-isopropyl-1,2,4-triazole-3-thiolate Formula: C11H11BrN3S- MolecularWeight: 297.19414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2=CC=CC=C2Br)[S-]

Isomeric SMILES

CC(C)C1=NN=C(N1C2=CC=CC=C2Br)[S-]

InChI

InChI=1S/C11H12BrN3S/c1-7(2)10-13-14-11(16)15(10)9-6-4-3-5-8(9)12/h3-7H,1-2H3,(H,14,16)/p-1