methyl 4-cyano-5-methylsulfanyl-3-phenyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-cyano-5-methylsulfanyl-3-phenyl-thiophene-2-carboxylate Openeye Name: methyl 4-cyano-5-methylsulfanyl-3-phenyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-(methylthio)-3-phenyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-5-methylsulfanyl-3-phenylthiophene-2-carboxylate Traditional Name: 4-cyano-5-(methylthio)-3-phenyl-thiophene-2-carboxylic acid methyl ester Formula: C14H11NO2S2 MolecularWeight: 289.37264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11NO2S2/c1-17-13(16)12-11(9-6-4-3-5-7-9)10(8-15)14(18-2)19-12/h3-7H,1-2H3