Vitas-M small molecule compound

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

Catalog ID
STK740876
SMILES COc1ccc2c(c1)ccc(n2)/C=C/1\SC(=S)N(C1=O)CC(=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 C16H12N2O4S2 MW 360.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O4S2/c1-22-11-4-5-12-9(6-11)2-3-10(17-12)7-13-15(21)18(8-14(19)20)16(23)24-13/h2-7H,8H2,1H3,(H,19,20)/b13-7-
InChIKey
KZXSHXREGXPKAA-QPEQYQDCSA-N
Synonyms
902030-33-5
((5Z)5((6methoxyquinolin2yl)methylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
(Z)2(5((6methoxyquinolin2yl)methylene)4oxo2thioxothiazolidin3yl)aceticacid
2((5Z)5((6METHOXYQUINOLIN2YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
2(5((6METHOXY(2QUINOLYL))METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
902030335
COC1=CC2=C(C=C1)N=C(C=C2)C=C3C(=O)N(C(=S)S3)CC(=O)O
COc1ccc2c(c1)ccc(n2)C=C1SC(=S)N(C1=O)CC(=O)O
InChI=1SC16H12N2O4S2c1221145129(611)2310(1712)71315(21)18(814(19)20)16(23)2413h27H8H21H3(H1920)b137
MFCD06788141
ZINC000006660571
ZINC6660571

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.