1-(4-bromophenyl)-2-[[5-(2-propan-2-yloxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-bromophenyl)-2-[[5-(2-propan-2-yloxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-(4-bromophenyl)-2-[[5-(2-isopropoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(4-bromophenyl)-2-[[5-(2-propan-2-yloxyphenyl)-1H-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(4-bromophenyl)-2-[[5-(2-propan-2-yloxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-(4-bromophenyl)-2-[[5-(2-isopropoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]ethanone Formula: C19H18BrN3O2S MolecularWeight: 432.33412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C2=NC(=NN2)SCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)OC1=CC=CC=C1C2=NC(=NN2)SCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H18BrN3O2S/c1-12(2)25-17-6-4-3-5-15(17)18-21-19(23-22-18)26-11-16(24)13-7-9-14(20)10-8-13/h3-10,12H,11H2,1-2H3,(H,21,22,23)