prop-2-enyl 4-methyl-2-[2-[3-(3-methylbutoxy)phenyl]-4-oxidanyl-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-1-yl]-1,3-thiazole-5-carboxylate

Systemtic Name: prop-2-enyl 4-methyl-2-[2-[3-(3-methylbutoxy)phenyl]-4-oxidanyl-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-1-yl]-1,3-thiazole-5-carboxylate Openeye Name: allyl 2-[4-hydroxy-2-(3-isopentyloxyphenyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[4-hydroxy-2-[3-(3-methylbutoxy)phenyl]-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-1-yl]-4-methyl-5-thiazolecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[4-hydroxy-2-[3-(3-methylbutoxy)phenyl]-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[4-hydroxy-2-(3-isoamoxyphenyl)-5-keto-3-(2-thenoyl)-3-pyrrolin-1-yl]-4-methyl-thiazole-5-carboxylic acid allyl ester Formula: C28H28N2O6S2 MolecularWeight: 552.66172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC(=CC=C4)OCCC(C)C)C(=O)OCC=C

Isomeric SMILES

CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC(=CC=C4)OCCC(C)C)C(=O)OCC=C

InChI

InChI=1S/C28H28N2O6S2/c1-5-12-36-27(34)25-17(4)29-28(38-25)30-22(18-8-6-9-19(15-18)35-13-11-16(2)3)21(24(32)26(30)33)23(31)20-10-7-14-37-20/h5-10,14-16,22,32H,1,11-13H2,2-4H3