3-(4-chlorophenyl)-5-methylsulfanyl-thiophene-2-carboxylate

Systemtic Name: 3-(4-chlorophenyl)-5-methylsulfanyl-thiophene-2-carboxylate Openeye Name: 3-(4-chlorophenyl)-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 3-(4-chlorophenyl)-5-(methylthio)-2-thiophenecarboxylate IUPAC Name: 3-(4-chlorophenyl)-5-methylsulfanylthiophene-2-carboxylate Traditional Name: 3-(4-chlorophenyl)-5-(methylthio)-2-thenoate Formula: C12H8ClO2S2- MolecularWeight: 283.77372

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(S1)C(=O)[O-])C2=CC=C(C=C2)Cl

Isomeric SMILES

CSC1=CC(=C(S1)C(=O)[O-])C2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H9ClO2S2/c1-16-10-6-9(11(17-10)12(14)15)7-2-4-8(13)5-3-7/h2-6H,1H3,(H,14,15)/p-1