N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-5-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl)pentanamide

Systemtic Name: N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-5-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl)pentanamide Openeye Name: N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-5-(4-oxo-2-thioxo-thiazolidin-3-yl)pentanamide CAS Name: N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-5-(4-oxo-2-sulfanylidene-3-thiazolidinyl)pentanamide IUPAC Name: N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-5-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)pentanamide Traditional Name: N-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyl]-5-(4-keto-2-thioxo-thiazolidin-3-yl)valeramide Formula: C20H26N2O4S2 MolecularWeight: 422.56144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)CCCCN3C(=O)CSC3=S

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)CNC(=O)CCCCN3C(=O)CSC3=S

InChI

InChI=1S/C20H26N2O4S2/c1-3-25-16-9-14-8-13(2)26-17(14)10-15(16)11-21-18(23)6-4-5-7-22-19(24)12-28-20(22)27/h9-10,13H,3-8,11-12H2,1-2H3,(H,21,23)/t13-/m0/s1