ethyl 2-[(3E)-2-(3-ethoxy-4-pentoxy-phenyl)-4,5-bis(oxidanylidene)-3-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(3E)-2-(3-ethoxy-4-pentoxy-phenyl)-4,5-bis(oxidanylidene)-3-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(3E)-2-(3-ethoxy-4-pentoxy-phenyl)-3-[hydroxy(4-pyridyl)methylene]-4,5-dioxo-pyrrolidin-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[(3E)-2-(3-ethoxy-4-pentoxyphenyl)-3-[hydroxy(pyridin-4-yl)methylidene]-4,5-dioxo-1-pyrrolidinyl]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3E)-2-(3-ethoxy-4-pentoxyphenyl)-3-[hydroxy(pyridin-4-yl)methylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(3E)-2-(4-amoxy-3-ethoxy-phenyl)-3-[hydroxy(4-pyridyl)methylene]-4,5-diketo-pyrrolidino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C30H33N3O7S MolecularWeight: 579.66392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C2C(=C(C3=CC=NC=C3)O)C(=O)C(=O)N2C4=NC(=C(S4)C(=O)OCC)C)OCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)C2/C(=C(/C3=CC=NC=C3)\O)/C(=O)C(=O)N2C4=NC(=C(S4)C(=O)OCC)C)OCC

InChI

InChI=1S/C30H33N3O7S/c1-5-8-9-16-40-21-11-10-20(17-22(21)38-6-2)24-23(25(34)19-12-14-31-15-13-19)26(35)28(36)33(24)30-32-18(4)27(41-30)29(37)39-7-3/h10-15,17,24,34H,5-9,16H2,1-4H3/b25-23+