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

Systemtic Name: 2-[(5Z)-5-[[(2R)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonate Openeye Name: 2-[(5Z)-5-[[(2R)-2-methyl-2,3-dihydrobenzofuran-5-yl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]ethanesulfonate CAS Name: 2-[(5Z)-5-[[(2R)-2-methyl-2,3-dihydrobenzofuran-5-yl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]ethanesulfonate IUPAC Name: 2-[(5Z)-5-[[(2R)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonate Traditional Name: 2-[(5Z)-4-keto-5-[[(2R)-2-methylcoumaran-5-yl]methylene]-2-thioxo-thiazolidin-3-yl]ethanesulfonate Formula: C15H14NO5S3- MolecularWeight: 384.47036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15NO5S3/c1-9-6-11-7-10(2-3-12(11)21-9)8-13-14(17)16(15(22)23-13)4-5-24(18,19)20/h2-3,7-9H,4-6H2,1H3,(H,18,19,20)/p-1/b13-8-/t9-/m1/s1