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

Systemtic Name: 4-(4-chlorophenyl)sulfonyl-3-methyl-5-methylsulfanyl-thiophene-2-carboxylate Openeye Name: 4-(4-chlorophenyl)sulfonyl-3-methyl-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 4-(4-chlorophenyl)sulfonyl-3-methyl-5-(methylthio)-2-thiophenecarboxylate IUPAC Name: 4-(4-chlorophenyl)sulfonyl-3-methyl-5-methylsulfanylthiophene-2-carboxylate Traditional Name: 4-(4-chlorophenyl)sulfonyl-3-methyl-5-(methylthio)-2-thenoate Formula: C13H10ClO4S3- MolecularWeight: 361.8641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1S(=O)(=O)C2=CC=C(C=C2)Cl)SC)C(=O)[O-]

Isomeric SMILES

CC1=C(SC(=C1S(=O)(=O)C2=CC=C(C=C2)Cl)SC)C(=O)[O-]

InChI

InChI=1S/C13H11ClO4S3/c1-7-10(12(15)16)20-13(19-2)11(7)21(17,18)9-5-3-8(14)4-6-9/h3-6H,1-2H3,(H,15,16)/p-1