Vitas-M small molecule compound
3-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(pyrrolidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK820019
SMILES CCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCCC2)/C1=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 C22H26N4O2S2 MW 442.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O2S2/c1-2-3-4-6-14-26-21(28)17(30-22(26)29)15-16-19(24-11-8-9-12-24)23-18-10-5-7-13-25(18)20(16)27/h5,7,10,13,15H,2-4,6,8-9,11-12,14H2,1H3/b17-15-InChIKey
QHKGVZPVRGUVQZ-ICFOKQHNSA-NSynonyms
(5Z)3HEXYL5((4OXO2PYRROLIDIN1YLPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3hexyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(pyrrolidin1yl)4Hpyrido(12a)pyrimidin4one
CCCCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCCC4)SC1=S
CCCCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCCC2)C1=O
InChI=1SC22H26N4O2S2c12346142621(28)17(3022(26)29)151619(2411891224)231810571325(18)20(16)27h57101315H24689111214H21H3b1715
MFCD04448709
ZINC000016741304
ZINC16741304
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