Vitas-M small molecule compound
3-[(Z)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[(2-hydroxyethyl)amino]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK797790
SMILES CCCCN1C(=S)S/C(=C\c2c(NCCO)nc3n(c2=O)cccc3C)/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 C19H22N4O3S2 MW 418.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4O3S2/c1-3-4-8-23-18(26)14(28-19(23)27)11-13-15(20-7-10-24)21-16-12(2)6-5-9-22(16)17(13)25/h5-6,9,11,20,24H,3-4,7-8,10H2,1-2H3/b14-11-InChIKey
AOYHOOBAHRSNFL-KAMYIIQDSA-NSynonyms
(5Z)3BUTYL5((2(2HYDROXYETHYLAMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3butyl4oxo2thioxo13thiazolidin5ylidene)methyl)2((2hydroxyethyl)amino)9methyl4Hpyrido(12a)pyrimidin4one
CCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)NCCO)SC1=S
CCCCN1C(=S)SC(=Cc2c(NCCO)nc3n(c2=O)cccc3C)C1=O
InChI=1SC19H22N4O3S2c13482318(26)14(2819(23)27)111315(2071024)211612(2)65922(16)17(13)25h569112024H347810H212H3b1411
MFCD03144787
ZINC000002992050
ZINC2992050
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