1-[4-methoxy-3-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl]ethanone

Systemtic Name: 1-[4-methoxy-3-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl]ethanone Openeye Name: 1-[4-methoxy-3-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl]ethanone CAS Name: 1-[4-methoxy-3-[[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]phenyl]ethanone IUPAC Name: 1-[4-methoxy-3-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl]ethanone Traditional Name: 1-[4-methoxy-3-[[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]phenyl]ethanone Formula: C13H14N2O2S3 MolecularWeight: 326.45746

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NN=C(S2)SC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NN=C(S2)SC

InChI

InChI=1S/C13H14N2O2S3/c1-8(16)9-4-5-11(17-2)10(6-9)7-19-13-15-14-12(18-3)20-13/h4-6H,7H2,1-3H3