1-(5-bromanylthiophen-2-yl)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(5-bromanylthiophen-2-yl)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(5-bromo-2-thienyl)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(5-bromo-2-thiophenyl)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(5-bromothiophen-2-yl)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(5-bromo-2-thienyl)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]ethanone Formula: C12H12BrN3OS2 MolecularWeight: 358.27718

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC=C(S2)Br)C3CC3

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC=C(S2)Br)C3CC3

InChI

InChI=1S/C12H12BrN3OS2/c1-16-11(7-2-3-7)14-15-12(16)18-6-8(17)9-4-5-10(13)19-9/h4-5,7H,2-3,6H2,1H3