methyl 4-cyano-5-methylsulfanyl-3-thiophen-2-yl-thiophene-2-carboxylate

Systemtic Name: methyl 4-cyano-5-methylsulfanyl-3-thiophen-2-yl-thiophene-2-carboxylate Openeye Name: methyl 4-cyano-5-methylsulfanyl-3-(2-thienyl)thiophene-2-carboxylate CAS Name: 4-cyano-5-(methylthio)-3-thiophen-2-yl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-5-methylsulfanyl-3-thiophen-2-ylthiophene-2-carboxylate Traditional Name: 4-cyano-5-(methylthio)-3-(2-thienyl)thiophene-2-carboxylic acid methyl ester Formula: C12H9NO2S3 MolecularWeight: 295.40036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(S1)SC)C#N)C2=CC=CS2

Isomeric SMILES

COC(=O)C1=C(C(=C(S1)SC)C#N)C2=CC=CS2

InChI

InChI=1S/C12H9NO2S3/c1-15-11(14)10-9(8-4-3-5-17-8)7(6-13)12(16-2)18-10/h3-5H,1-2H3