Vitas-M small molecule compound
3-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(pyrrolidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK819590
SMILES CCOCCCN1C(=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 C21H24N4O3S2 MW 444.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O3S2/c1-2-28-13-7-12-25-20(27)16(30-21(25)29)14-15-18(23-9-5-6-10-23)22-17-8-3-4-11-24(17)19(15)26/h3-4,8,11,14H,2,5-7,9-10,12-13H2,1H3/b16-14-InChIKey
NXJFEOAEXYOOIO-PEZBUJJGSA-NSynonyms
(5Z)3(3ETHOXYPROPYL)5((4OXO2PYRROLIDIN1YLPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3(3ethoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(pyrrolidin1yl)4Hpyrido(12a)pyrimidin4one
CCOCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCCC4)SC1=S
CCOCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCCC2)C1=O
InChI=1SC21H24N4O3S2c1228137122520(27)16(3021(25)29)141518(239561023)22178341124(17)19(15)26h3481114H2579101213H21H3b1614
MFCD04448499
ZINC000016741253
ZINC16741253
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