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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C2=CC=CC=C2Br)[S-]

Isomeric SMILES

CCCC1=NN=C(N1C2=CC=CC=C2Br)[S-]

InChI

InChI=1S/C11H12BrN3S/c1-2-5-10-13-14-11(16)15(10)9-7-4-3-6-8(9)12/h3-4,6-7H,2,5H2,1H3,(H,14,16)/p-1