1-(3-bromanyl-4-methoxy-phenyl)-2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(3-bromanyl-4-methoxy-phenyl)-2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(3-bromo-4-methoxy-phenyl)-2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-(3-bromo-4-methoxyphenyl)-2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]thio]ethanone IUPAC Name: 1-(3-bromo-4-methoxyphenyl)-2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-(3-bromo-4-methoxy-phenyl)-2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]thio]ethanone Formula: C12H12BrN3O2S2 MolecularWeight: 374.27658

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NN=C(S1)SCC(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CNC1=NN=C(S1)SCC(=O)C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C12H12BrN3O2S2/c1-14-11-15-16-12(20-11)19-6-9(17)7-3-4-10(18-2)8(13)5-7/h3-5H,6H2,1-2H3,(H,14,15)