1-(4-ethanoylphenyl)-2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanone

Systemtic Name: 1-(4-ethanoylphenyl)-2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanone Openeye Name: 1-(4-acetylphenyl)-2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanone CAS Name: 1-(4-acetylphenyl)-2-[[3-(methylthio)-1,2,4-thiadiazol-5-yl]thio]ethanone IUPAC Name: 1-(4-acetylphenyl)-2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanone Traditional Name: 1-(4-acetylphenyl)-2-[[3-(methylthio)-1,2,4-thiadiazol-5-yl]thio]ethanone Formula: C13H12N2O2S3 MolecularWeight: 324.44158

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C(=O)CSC2=NC(=NS2)SC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C(=O)CSC2=NC(=NS2)SC

InChI

InChI=1S/C13H12N2O2S3/c1-8(16)9-3-5-10(6-4-9)11(17)7-19-13-14-12(18-2)15-20-13/h3-6H,7H2,1-2H3