Vitas-M small molecule compound
3-{(Z)-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(pyrrolidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK819586
SMILES S=C1S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCCC2)/C(=O)N1CC1CCCO1
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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 C21H22N4O3S2 MW 442.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3S2/c26-19-15(12-16-20(27)25(21(29)30-16)13-14-6-5-11-28-14)18(23-8-3-4-9-23)22-17-7-1-2-10-24(17)19/h1-2,7,10,12,14H,3-6,8-9,11,13H2/b16-12-InChIKey
QLBJGPQTYGUARD-VBKFSLOCSA-NSynonyms
(5Z)3(OXOLAN2YLMETHYL)5((4OXO2PYRROLIDIN1YLPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(4oxo3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin5ylidene)methyl)2(pyrrolidin1yl)4Hpyrido(12a)pyrimidin4one
C1CCN(C1)C2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CC5CCCO5
InChI=1SC21H22N4O3S2c261915(121620(27)25(21(29)3016)131465112814)18(23834923)22177121024(17)19h127101214H36891113H2b1612
MFCD04448495
S=C1SC(=Cc2c(nc3n(c2=O)cccc3)N2CCCC2)C(=O)N1CC1CCCO1
ZINC000016741248
ZINC000016741249
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