2-[5-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioic acid

Systemtic Name: 2-[5-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioic acid Openeye Name: 2-[5-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanedioic acid CAS Name: 2-[5-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanedioic acid IUPAC Name: 2-[5-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioic acid Traditional Name: 2-[4-keto-5-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methylene]-2-thioxo-thiazolidin-3-yl]succinic acid Formula: C18H18N2O5S2 MolecularWeight: 406.47592

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC2=C1C=CC(=C2)C=C3C(=O)N(C(=S)S3)C(CC(=O)O)C(=O)O

Isomeric SMILES

CN1CCCC2=C1C=CC(=C2)C=C3C(=O)N(C(=S)S3)C(CC(=O)O)C(=O)O

InChI

InChI=1S/C18H18N2O5S2/c1-19-6-2-3-11-7-10(4-5-12(11)19)8-14-16(23)20(18(26)27-14)13(17(24)25)9-15(21)22/h4-5,7-8,13H,2-3,6,9H2,1H3,(H,21,22)(H,24,25)