2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[(4-chlorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]thio]acetate IUPAC Name: 2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-[(4-chlorobenzyl)thio]-1,3,4-thiadiazol-2-yl]thio]acetate Formula: C11H8ClN2O2S3- MolecularWeight: 331.84142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NN=C(S2)SCC(=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CSC2=NN=C(S2)SCC(=O)[O-])Cl

InChI

InChI=1S/C11H9ClN2O2S3/c12-8-3-1-7(2-4-8)5-17-10-13-14-11(19-10)18-6-9(15)16/h1-4H,5-6H2,(H,15,16)/p-1