Vitas-M small molecule compound

2-{(5Z)-5-[(6-methoxyquinolin-2-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}pentanedioic acid

Catalog ID
STL307763
SMILES COc1ccc2c(c1)ccc(n2)/C=C/1\SC(=S)N(C1=O)C(C(=O)O)CCC(=O)O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C19H16N2O6S2 MW 432.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O6S2/c1-27-12-4-5-13-10(8-12)2-3-11(20-13)9-15-17(24)21(19(28)29-15)14(18(25)26)6-7-16(22)23/h2-5,8-9,14H,6-7H2,1H3,(H,22,23)(H,25,26)/b15-9-
InChIKey
YOMGGZJPEWEYND-DHDCSXOGSA-N
Synonyms

(E)2(5((6methoxyquinolin2yl)methylene)4oxo2thioxothiazolidin3yl)pentanedioicacid
2((5Z)5((6methoxyquinolin2yl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)pentanedioicacid
2((5Z)5((6methoxyquinolin2yl)methylidene)4oxo2thioxo13thiazolidin3yl)pentanedioicacid
2(5((6METHOXY(2QUINOLYL))METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)PENTANEDIOICACID
COC1=CC2=C(C=C1)N=C(C=C2)C=C3C(=O)N(C(=S)S3)C(CCC(=O)O)C(=O)O
COc1ccc2c(c1)ccc(n2)C=C1SC(=S)N(C1=O)C(C(=O)O)CCC(=O)O
InChI=1SC19H16N2O6S2c12712451310(812)2311(2013)91517(24)21(19(28)2915)14(18(25)26)6716(22)23h258914H67H21H3(H2223)(H2526)b159
MFCD28025033
ZINC000054360851
ZINC000054360852

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Available files

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