[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid [2-(3,4-dimethoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl ester Formula: C20H19NO5S2 MolecularWeight: 417.49856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)CCC(=O)C3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)CCC(=O)C3=CC=CS3)OC

InChI

InChI=1S/C20H19NO5S2/c1-24-16-7-5-13(10-17(16)25-2)20-21-14(12-28-20)11-26-19(23)8-6-15(22)18-4-3-9-27-18/h3-5,7,9-10,12H,6,8,11H2,1-2H3