ethyl 2-[[(E)-2-cyano-3-methoxy-1-methylsulfanyl-3-oxidanylidene-prop-1-enyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(E)-2-cyano-3-methoxy-1-methylsulfanyl-3-oxidanylidene-prop-1-enyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[(E)-2-cyano-3-methoxy-1-methylsulfanyl-3-oxo-prop-1-enyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-3-methoxy-1-(methylthio)-3-oxoprop-1-enyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-2-cyano-3-methoxy-1-methylsulfanyl-3-oxoprop-1-enyl]amino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-keto-3-methoxy-1-(methylthio)prop-1-enyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H20N2O4S2 MolecularWeight: 416.5138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=C(C#N)C(=O)OC)SC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)N/C(=C(/C#N)\C(=O)OC)/SC

InChI

InChI=1S/C20H20N2O4S2/c1-5-26-20(24)16-15(13-9-7-6-8-10-13)12(2)28-18(16)22-17(27-4)14(11-21)19(23)25-3/h6-10,22H,5H2,1-4H3/b17-14+