2-[[4-(4-bromanyl-2-chloranyl-phenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[4-(4-bromanyl-2-chloranyl-phenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4-(4-bromo-2-chloro-phenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[4-(4-bromo-2-chlorophenyl)-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[4-(4-bromo-2-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-(4-bromo-2-chloro-phenyl)-1,2,4-triazol-3-yl]thio]acetic acid Formula: C10H7BrClN3O2S MolecularWeight: 348.60348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Cl)N2C=NN=C2SCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)Cl)N2C=NN=C2SCC(=O)O

InChI

InChI=1S/C10H7BrClN3O2S/c11-6-1-2-8(7(12)3-6)15-5-13-14-10(15)18-4-9(16)17/h1-3,5H,4H2,(H,16,17)