Vitas-M small molecule compound
6-[(5Z)-4-oxo-5-{[4-oxo-2-(prop-2-en-1-ylamino)-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid
Catalog ID
STK703504
SMILES C=CCNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCCCCC(=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 C21H22N4O4S2 MW 458.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4S2/c1-2-10-22-18-14(19(28)24-11-7-5-8-16(24)23-18)13-15-20(29)25(21(30)31-15)12-6-3-4-9-17(26)27/h2,5,7-8,11,13,22H,1,3-4,6,9-10,12H2,(H,26,27)/b15-13-InChIKey
JIHOCCRDESSXRS-SQFISAMPSA-NSynonyms
469879-43-4(Z)6(5((2(allylamino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)4oxo2thioxothiazolidin3yl)hexanoicacid
469879434
6((5Z)4oxo5((4oxo2(prop2en1ylamino)4Hpyrido(12a)pyrimidin3yl)methylidene)2thioxo13thiazolidin3yl)hexanoicacid
6((5Z)4OXO5((4OXO2(PROP2ENYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOICACID
C=CCNC1=C(C(=O)N2C=CC=CC2=N1)C=C3C(=O)N(C(=S)S3)CCCCCC(=O)O
C=CCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)CCCCCC(=O)O
InChI=1SC21H22N4O4S2c1210221814(19(28)241175816(24)2318)131520(29)25(21(30)3115)12634917(26)27h2578111322H134691012H2(H2627)b1513
MFCD03212229
ZINC000008915541
ZINC8915541
Check stock
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Check stock on Vitas-MAvailable files
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