1-(2,5-dimethylphenyl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(2,5-dimethylphenyl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propan-1-one Openeye Name: 1-(2,5-dimethylphenyl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propan-1-one CAS Name: 1-(2,5-dimethylphenyl)-2-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]-1-propanone IUPAC Name: 1-(2,5-dimethylphenyl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propan-1-one Traditional Name: 1-(2,5-dimethylphenyl)-2-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]propan-1-one Formula: C14H16N2OS3 MolecularWeight: 324.48464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)C(C)SC2=NN=C(S2)SC

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)C(C)SC2=NN=C(S2)SC

InChI

InChI=1S/C14H16N2OS3/c1-8-5-6-9(2)11(7-8)12(17)10(3)19-14-16-15-13(18-4)20-14/h5-7,10H,1-4H3