4-[(5Z)-5-[[(2R)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate

Systemtic Name: 4-[(5Z)-5-[[(2R)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: 4-[(5Z)-5-[[(2R)-2-methyl-2,3-dihydrobenzofuran-5-yl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5Z)-5-[[(2R)-2-methyl-2,3-dihydrobenzofuran-5-yl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoate IUPAC Name: 4-[(5Z)-5-[[(2R)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5Z)-4-keto-5-[[(2R)-2-methylcoumaran-5-yl]methylene]-2-thioxo-thiazolidin-3-yl]butyrate Formula: C17H16NO4S2- MolecularWeight: 362.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=CC(=C2)C=C3C(=O)N(C(=S)S3)CCCC(=O)[O-]

Isomeric SMILES

C[C@@H]1CC2=C(O1)C=CC(=C2)/C=C\3/C(=O)N(C(=S)S3)CCCC(=O)[O-]

InChI

InChI=1S/C17H17NO4S2/c1-10-7-12-8-11(4-5-13(12)22-10)9-14-16(21)18(17(23)24-14)6-2-3-15(19)20/h4-5,8-10H,2-3,6-7H2,1H3,(H,19,20)/p-1/b14-9-/t10-/m1/s1