2-[(5Z)-5-[(2-methyl-2H-chromen-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid

Systemtic Name: 2-[(5Z)-5-[(2-methyl-2H-chromen-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid Openeye Name: 2-[(5Z)-5-[(2-methyl-2H-chromen-3-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]ethanesulfonic acid CAS Name: 2-[(5Z)-5-[(2-methyl-2H-1-benzopyran-3-yl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]ethanesulfonic acid IUPAC Name: 2-[(5Z)-5-[(2-methyl-2H-chromen-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid Traditional Name: 2-[(5Z)-4-keto-5-[(2-methyl-2H-chromen-3-yl)methylene]-2-thioxo-thiazolidin-3-yl]ethanesulfonic acid Formula: C16H15NO5S3 MolecularWeight: 397.489

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=CC2=CC=CC=C2O1)C=C3C(=O)N(C(=S)S3)CCS(=O)(=O)O

Isomeric SMILES

CC1C(=CC2=CC=CC=C2O1)/C=C\3/C(=O)N(C(=S)S3)CCS(=O)(=O)O

InChI

InChI=1S/C16H15NO5S3/c1-10-12(8-11-4-2-3-5-13(11)22-10)9-14-15(18)17(16(23)24-14)6-7-25(19,20)21/h2-5,8-10H,6-7H2,1H3,(H,19,20,21)/b14-9-