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

Systemtic Name: diethyl 5-[3-cyano-4-[1-(4-dimethylaminophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[3-cyano-4-[1-(4-dimethylaminophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[3-cyano-4-[1-(4-dimethylaminophenyl)-2,5-dimethyl-3-pyrrolyl]-2-oxobut-3-enyl]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[3-cyano-4-[1-(4-dimethylaminophenyl)-2,5-dimethylpyrrol-3-yl]-2-oxobut-3-enyl]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[3-cyano-4-[1-(4-dimethylaminophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-keto-but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C30H33N3O5S MolecularWeight: 547.66512

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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)C3=CC=C(C=C3)N(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)C3=CC=C(C=C3)N(C)C)C)C#N

InChI

InChI=1S/C30H33N3O5S/c1-8-37-29(35)27-19(4)28(30(36)38-9-2)39-26(27)16-25(34)22(17-31)15-21-14-18(3)33(20(21)5)24-12-10-23(11-13-24)32(6)7/h10-15H,8-9,16H2,1-7H3