prop-2-enyl 2-[2-[3-ethoxy-4-(3-methylbutoxy)phenyl]-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: prop-2-enyl 2-[2-[3-ethoxy-4-(3-methylbutoxy)phenyl]-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: allyl 2-[2-(3-ethoxy-4-isopentyloxy-phenyl)-4-hydroxy-3-(7-methoxybenzofuran-2-carbonyl)-5-oxo-2H-pyrrol-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[2-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4-hydroxy-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-5-oxo-2H-pyrrol-1-yl]-4-methyl-5-thiazolecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[2-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-5-oxo-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[2-(3-ethoxy-4-isoamoxy-phenyl)-4-hydroxy-5-keto-3-(7-methoxybenzofuran-2-carbonyl)-3-pyrrolin-1-yl]-4-methyl-thiazole-5-carboxylic acid allyl ester Formula: C35H36N2O9S MolecularWeight: 660.73334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2C3=NC(=C(S3)C(=O)OCC=C)C)O)C(=O)C4=CC5=C(O4)C(=CC=C5)OC)OCCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2C3=NC(=C(S3)C(=O)OCC=C)C)O)C(=O)C4=CC5=C(O4)C(=CC=C5)OC)OCCC(C)C

InChI

InChI=1S/C35H36N2O9S/c1-7-15-45-34(41)32-20(5)36-35(47-32)37-28(21-12-13-23(25(17-21)43-8-2)44-16-14-19(3)4)27(30(39)33(37)40)29(38)26-18-22-10-9-11-24(42-6)31(22)46-26/h7,9-13,17-19,28,39H,1,8,14-16H2,2-6H3