ethyl 4-methyl-2-[4-oxidanyl-5-oxidanylidene-2-(3-phenoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[4-oxidanyl-5-oxidanylidene-2-(3-phenoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[4-hydroxy-5-oxo-2-(3-phenoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[4-hydroxy-5-oxo-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2-(3-phenoxyphenyl)-2H-pyrrol-1-yl]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-hydroxy-5-oxo-2-(3-phenoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-hydroxy-2-keto-5-(3-phenoxyphenyl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-1-yl]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C32H26N2O6S MolecularWeight: 566.62364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C2=O)O)C(=O)C=CC3=CC=CC=C3)C4=CC(=CC=C4)OC5=CC=CC=C5)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C2=O)O)C(=O)/C=C/C3=CC=CC=C3)C4=CC(=CC=C4)OC5=CC=CC=C5)C

InChI

InChI=1S/C32H26N2O6S/c1-3-39-31(38)29-20(2)33-32(41-29)34-27(22-13-10-16-24(19-22)40-23-14-8-5-9-15-23)26(28(36)30(34)37)25(35)18-17-21-11-6-4-7-12-21/h4-19,27,36H,3H2,1-2H3/b18-17+