diethyl 5-[3-cyano-2-oxidanylidene-4-(1,2,5-trimethylpyrrol-3-yl)but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[3-cyano-2-oxidanylidene-4-(1,2,5-trimethylpyrrol-3-yl)but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[3-cyano-2-oxo-4-(1,2,5-trimethylpyrrol-3-yl)but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[3-cyano-2-oxo-4-(1,2,5-trimethyl-3-pyrrolyl)but-3-enyl]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[3-cyano-2-oxo-4-(1,2,5-trimethylpyrrol-3-yl)but-3-enyl]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[3-cyano-2-keto-4-(1,2,5-trimethylpyrrol-3-yl)but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)CC(=O)C(=CC2=C(N(C(=C2)C)C)C)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)CC(=O)C(=CC2=C(N(C(=C2)C)C)C)C#N

InChI

InChI=1S/C23H26N2O5S/c1-7-29-22(27)20-14(4)21(23(28)30-8-2)31-19(20)11-18(26)17(12-24)10-16-9-13(3)25(6)15(16)5/h9-10H,7-8,11H2,1-6H3