ethyl 2-[(4E)-2,3-bis(oxidanylidene)-4-[oxidanyl-(3-propoxyphenyl)methylidene]-5-(4-prop-2-enoxyphenyl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(4E)-2,3-bis(oxidanylidene)-4-[oxidanyl-(3-propoxyphenyl)methylidene]-5-(4-prop-2-enoxyphenyl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(3E)-2-(4-allyloxyphenyl)-3-[hydroxy-(3-propoxyphenyl)methylene]-4,5-dioxo-pyrrolidin-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[(4E)-4-[hydroxy-(3-propoxyphenyl)methylidene]-2,3-dioxo-5-(4-prop-2-enoxyphenyl)-1-pyrrolidinyl]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4E)-4-[hydroxy-(3-propoxyphenyl)methylidene]-2,3-dioxo-5-(4-prop-2-enoxyphenyl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(3E)-2-(4-allyloxyphenyl)-3-[hydroxy-(3-propoxyphenyl)methylene]-4,5-diketo-pyrrolidino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C30H30N2O7S MolecularWeight: 562.6334

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC)C)C4=CC=C(C=C4)OCC=C)O

Isomeric SMILES

CCCOC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC)C)C4=CC=C(C=C4)OCC=C)/O

InChI

InChI=1S/C30H30N2O7S/c1-5-15-38-21-13-11-19(12-14-21)24-23(25(33)20-9-8-10-22(17-20)39-16-6-2)26(34)28(35)32(24)30-31-18(4)27(40-30)29(36)37-7-3/h5,8-14,17,24,33H,1,6-7,15-16H2,2-4H3/b25-23+