methyl 3-(4-chlorophenyl)-4-cyano-5-methyl-1-sulfanylidene-thiophene-2-carboxylate

Systemtic Name: methyl 3-(4-chlorophenyl)-4-cyano-5-methyl-1-sulfanylidene-thiophene-2-carboxylate Openeye Name: methyl 3-(4-chlorophenyl)-4-cyano-5-methyl-1-thioxo-thiophene-2-carboxylate CAS Name: 3-(4-chlorophenyl)-4-cyano-5-methyl-1-sulfanylidene-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-(4-chlorophenyl)-4-cyano-5-methyl-1-sulfanylidenethiophene-2-carboxylate Traditional Name: 3-(4-chlorophenyl)-4-cyano-5-methyl-1-thioxo-thiophene-2-carboxylic acid methyl ester Formula: C14H10ClNO2S2 MolecularWeight: 323.8177

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1=S)C(=O)OC)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CC1=C(C(=C(S1=S)C(=O)OC)C2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C14H10ClNO2S2/c1-8-11(7-16)12(9-3-5-10(15)6-4-9)13(20(8)19)14(17)18-2/h3-6H,1-2H3