1-(2-bromophenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(2-bromophenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(2-bromophenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(2-bromophenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(2-bromophenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(2-bromophenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]ethanone Formula: C16H12BrN3OS MolecularWeight: 374.25498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NN=C2SCC(=O)C3=CC=CC=C3Br

Isomeric SMILES

C1=CC=C(C=C1)N2C=NN=C2SCC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C16H12BrN3OS/c17-14-9-5-4-8-13(14)15(21)10-22-16-19-18-11-20(16)12-6-2-1-3-7-12/h1-9,11H,10H2