diethyl 2-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]propanedioate

Systemtic Name: diethyl 2-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]propanedioate Openeye Name: diethyl 2-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]propanedioate CAS Name: 2-[[2-(4-tert-butyl-2-thiazolyl)-5-benzofuranyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]propanedioate Traditional Name: 2-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]malonic acid diethyl ester Formula: C23H27NO5S MolecularWeight: 429.52918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC2=C(C=C1)OC(=C2)C3=NC(=CS3)C(C)(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=CC2=C(C=C1)OC(=C2)C3=NC(=CS3)C(C)(C)C)C(=O)OCC

InChI

InChI=1S/C23H27NO5S/c1-6-27-21(25)16(22(26)28-7-2)11-14-8-9-17-15(10-14)12-18(29-17)20-24-19(13-30-20)23(3,4)5/h8-10,12-13,16H,6-7,11H2,1-5H3