methyl 2-acetamido-6-[2-(2,3-dihydro-1-benzofuran-5-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]hexanoate

Systemtic Name: methyl 2-acetamido-6-[2-(2,3-dihydro-1-benzofuran-5-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]hexanoate Openeye Name: methyl 2-acetamido-6-[2-(2,3-dihydrobenzofuran-5-yl)-4-oxo-thiazolidin-3-yl]hexanoate CAS Name: 2-acetamido-6-[2-(2,3-dihydrobenzofuran-5-yl)-4-oxo-3-thiazolidinyl]hexanoic acid methyl ester IUPAC Name: methyl 2-acetamido-6-[2-(2,3-dihydro-1-benzofuran-5-yl)-4-oxo-1,3-thiazolidin-3-yl]hexanoate Traditional Name: 2-acetamido-6-(2-coumaran-5-yl-4-keto-thiazolidin-3-yl)hexanoic acid methyl ester Formula: C20H26N2O5S MolecularWeight: 406.49584

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCCCN1C(SCC1=O)C2=CC3=C(C=C2)OCC3)C(=O)OC

Isomeric SMILES

CC(=O)NC(CCCCN1C(SCC1=O)C2=CC3=C(C=C2)OCC3)C(=O)OC

InChI

InChI=1S/C20H26N2O5S/c1-13(23)21-16(20(25)26-2)5-3-4-9-22-18(24)12-28-19(22)15-6-7-17-14(11-15)8-10-27-17/h6-7,11,16,19H,3-5,8-10,12H2,1-2H3,(H,21,23)