Vitas-M small molecule compound
[(5Z)-5-{[9-methyl-2-(4-methylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STK514929
SMILES CC1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/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 C21H22N4O4S2 MW 458.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4S2/c1-12-5-8-23(9-6-12)18-14(19(28)24-7-3-4-13(2)17(24)22-18)10-15-20(29)25(11-16(26)27)21(30)31-15/h3-4,7,10,12H,5-6,8-9,11H2,1-2H3,(H,26,27)/b15-10-InChIKey
OILFDDBILBPEDP-GDNBJRDFSA-NSynonyms
((5Z)5((9methyl2(4methylpiperidin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5Z)5((9METHYL2(4METHYLPIPERIDIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
CC1CCN(CC1)c1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)CC(=O)O
CC1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)CC(=O)O
InChI=1SC21H22N4O4S2c1125823(9612)1814(19(28)2473413(2)17(24)2218)101520(29)25(1116(26)27)21(30)3115h3471012H568911H212H3(H2627)b1510
MFCD06645045
ZINC000016741568
ZINC16741568
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