Vitas-M small molecule compound
3-[(Z)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[(3-ethoxypropyl)amino]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK611476
SMILES CCCCN1C(=S)S/C(=C\c2c(NCCCOCC)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 C22H28N4O3S2 MW 460.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O3S2/c1-4-6-11-26-21(28)17(31-22(26)30)14-16-18(23-10-8-13-29-5-2)24-19-15(3)9-7-12-25(19)20(16)27/h7,9,12,14,23H,4-6,8,10-11,13H2,1-3H3/b17-14-InChIKey
NSMOKPGRFRPEFT-VKAVYKQESA-NSynonyms
617682-20-9(5Z)3BUTYL5((2(3ETHOXYPROPYLAMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3butyl5((2((3ethoxypropyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3butyl4oxo2thioxo13thiazolidin5ylidene)methyl)2((3ethoxypropyl)amino)9methyl4Hpyrido(12a)pyrimidin4one
3BUTYL5((2((3ETHOXYPROPYL)AMINO)9METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
617682209
CCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)NCCCOCC)SC1=S
CCCCN1C(=S)SC(=Cc2c(NCCCOCC)nc3n(c2=O)cccc3C)C1=O
InChI=1SC22H28N4O3S2c146112621(28)17(3122(26)30)141618(23108132952)241915(3)971225(19)20(16)27h79121423H468101113H213H3b1714
MFCD03667625
ZINC000008859447
ZINC8859447
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.