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

Systemtic Name: 1-(5-bromanylthiophen-2-yl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(5-bromo-2-thienyl)-2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(5-bromo-2-thiophenyl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(5-bromothiophen-2-yl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(5-bromo-2-thienyl)-2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)thio]ethanone Formula: C11H12BrN3OS2 MolecularWeight: 346.26648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NN1)SCC(=O)C2=CC=C(S2)Br

Isomeric SMILES

CC(C)C1=NC(=NN1)SCC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C11H12BrN3OS2/c1-6(2)10-13-11(15-14-10)17-5-7(16)8-3-4-9(12)18-8/h3-4,6H,5H2,1-2H3,(H,13,14,15)