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

Systemtic Name: ethyl 2-[(3E)-2-(3-bromophenyl)-3-[(4-ethoxyphenyl)-oxidanyl-methylidene]-4,5-bis(oxidanylidene)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(3E)-2-(3-bromophenyl)-3-[(4-ethoxyphenyl)-hydroxy-methylene]-4,5-dioxo-pyrrolidin-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[(3E)-2-(3-bromophenyl)-3-[(4-ethoxyphenyl)-hydroxymethylidene]-4,5-dioxo-1-pyrrolidinyl]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3E)-2-(3-bromophenyl)-3-[(4-ethoxyphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(3E)-2-(3-bromophenyl)-3-[hydroxy(p-phenetyl)methylene]-4,5-diketo-pyrrolidino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C26H23BrN2O6S MolecularWeight: 571.43962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC)C)C4=CC(=CC=C4)Br)O

Isomeric SMILES

CCOC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC)C)C4=CC(=CC=C4)Br)/O

InChI

InChI=1S/C26H23BrN2O6S/c1-4-34-18-11-9-15(10-12-18)21(30)19-20(16-7-6-8-17(27)13-16)29(24(32)22(19)31)26-28-14(3)23(36-26)25(33)35-5-2/h6-13,20,30H,4-5H2,1-3H3/b21-19+