methyl 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: methyl 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: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C31H24N2O6S MolecularWeight: 552.59706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)C=CC3=CC=CC=C3)C4=CC(=CC=C4)OC5=CC=CC=C5)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)/C=C/C3=CC=CC=C3)C4=CC(=CC=C4)OC5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C31H24N2O6S/c1-19-28(30(37)38-2)40-31(32-19)33-26(21-12-9-15-23(18-21)39-22-13-7-4-8-14-22)25(27(35)29(33)36)24(34)17-16-20-10-5-3-6-11-20/h3-18,26,35H,1-2H3/b17-16+