3-[(3,4-dichlorophenyl)methylsulfanyl]thiophene-2-carboxylate

Systemtic Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]thiophene-2-carboxylate Openeye Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]thiophene-2-carboxylate CAS Name: 3-[(3,4-dichlorophenyl)methylthio]-2-thiophenecarboxylate IUPAC Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]thiophene-2-carboxylate Traditional Name: 3-[(3,4-dichlorobenzyl)thio]-2-thenoate Formula: C12H7Cl2O2S2- MolecularWeight: 318.21878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CSC2=C(SC=C2)C(=O)[O-])Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1CSC2=C(SC=C2)C(=O)[O-])Cl)Cl

InChI

InChI=1S/C12H8Cl2O2S2/c13-8-2-1-7(5-9(8)14)6-18-10-3-4-17-11(10)12(15)16/h1-5H,6H2,(H,15,16)/p-1