prop-2-enyl 2-[2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-4-oxidanyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: prop-2-enyl 2-[2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-4-oxidanyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: allyl 2-[2-(3-bromo-4-hydroxy-5-methoxy-phenyl)-4-hydroxy-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[2-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-hydroxy-5-oxo-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-1-yl]-4-methyl-5-thiazolecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[2-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-hydroxy-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[2-(3-bromo-4-hydroxy-5-methoxy-phenyl)-4-hydroxy-5-keto-3-[(E)-3-phenylacryloyl]-3-pyrrolin-1-yl]-4-methyl-thiazole-5-carboxylic acid allyl ester Formula: C28H23BrN2O7S MolecularWeight: 611.46042

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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(=C(C(=C4)Br)O)OC)C(=O)OCC=C

Isomeric SMILES

CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)/C=C/C3=CC=CC=C3)C4=CC(=C(C(=C4)Br)O)OC)C(=O)OCC=C

InChI

InChI=1S/C28H23BrN2O7S/c1-4-12-38-27(36)25-15(2)30-28(39-25)31-22(17-13-18(29)23(33)20(14-17)37-3)21(24(34)26(31)35)19(32)11-10-16-8-6-5-7-9-16/h4-11,13-14,22,33-34H,1,12H2,2-3H3/b11-10+