methyl 2-[3-(1-benzofuran-2-ylcarbonyl)-4-oxidanyl-5-oxidanylidene-2-(4-prop-2-enoxyphenyl)-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[3-(1-benzofuran-2-ylcarbonyl)-4-oxidanyl-5-oxidanylidene-2-(4-prop-2-enoxyphenyl)-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[2-(4-allyloxyphenyl)-3-(benzofuran-2-carbonyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[3-[2-benzofuranyl(oxo)methyl]-4-hydroxy-5-oxo-2-(4-prop-2-enoxyphenyl)-2H-pyrrol-1-yl]-4-methyl-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(1-benzofuran-2-carbonyl)-4-hydroxy-5-oxo-2-(4-prop-2-enoxyphenyl)-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[2-(4-allyloxyphenyl)-3-(benzofuran-2-carbonyl)-4-hydroxy-5-keto-3-pyrrolin-1-yl]-4-methyl-thiazole-5-carboxylic acid methyl ester Formula: C28H22N2O7S MolecularWeight: 530.54848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)C3=CC4=CC=CC=C4O3)C5=CC=C(C=C5)OCC=C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)C3=CC4=CC=CC=C4O3)C5=CC=C(C=C5)OCC=C)C(=O)OC

InChI

InChI=1S/C28H22N2O7S/c1-4-13-36-18-11-9-16(10-12-18)22-21(23(31)20-14-17-7-5-6-8-19(17)37-20)24(32)26(33)30(22)28-29-15(2)25(38-28)27(34)35-3/h4-12,14,22,32H,1,13H2,2-3H3