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

Systemtic Name: methyl 4-(4-chlorophenyl)sulfonyl-3-methyl-5-methylsulfanyl-thiophene-2-carboxylate Openeye Name: methyl 4-(4-chlorophenyl)sulfonyl-3-methyl-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 4-(4-chlorophenyl)sulfonyl-3-methyl-5-(methylthio)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-chlorophenyl)sulfonyl-3-methyl-5-methylsulfanylthiophene-2-carboxylate Traditional Name: 4-(4-chlorophenyl)sulfonyl-3-methyl-5-(methylthio)thiophene-2-carboxylic acid methyl ester Formula: C14H13ClO4S3 MolecularWeight: 376.89862

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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)OC

Isomeric SMILES

CC1=C(SC(=C1S(=O)(=O)C2=CC=C(C=C2)Cl)SC)C(=O)OC

InChI

InChI=1S/C14H13ClO4S3/c1-8-11(13(16)19-2)21-14(20-3)12(8)22(17,18)10-6-4-9(15)5-7-10/h4-7H,1-3H3