ethyl 4-cyano-5-[3-cyano-2-oxidanylidene-4-(5-phenylsulfanylfuran-2-yl)but-3-enyl]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[3-cyano-2-oxidanylidene-4-(5-phenylsulfanylfuran-2-yl)but-3-enyl]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[3-cyano-2-oxo-4-(5-phenylsulfanyl-2-furyl)but-3-enyl]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[3-cyano-2-oxo-4-[5-(phenylthio)-2-furanyl]but-3-enyl]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[3-cyano-2-oxo-4-(5-phenylsulfanylfuran-2-yl)but-3-enyl]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[3-cyano-2-keto-4-[5-(phenylthio)-2-furyl]but-3-enyl]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C24H18N2O4S2 MolecularWeight: 462.54072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)CC(=O)C(=CC2=CC=C(O2)SC3=CC=CC=C3)C#N)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)CC(=O)C(=CC2=CC=C(O2)SC3=CC=CC=C3)C#N)C#N)C

InChI

InChI=1S/C24H18N2O4S2/c1-3-29-24(28)23-15(2)19(14-26)21(32-23)12-20(27)16(13-25)11-17-9-10-22(30-17)31-18-7-5-4-6-8-18/h4-11H,3,12H2,1-2H3