Vitas-M small molecule compound
3-{(Z)-[3-(2-ethylhexyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-2-{[3-(propan-2-yloxy)propyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK881178
SMILES CCCCC(CN1C(=S)S/C(=C\c2c(NCCCOC(C)C)nc3n(c2=O)cccc3C)/C1=O)CC
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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 C27H38N4O3S2 MW 530.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H38N4O3S2/c1-6-8-12-20(7-2)17-31-26(33)22(36-27(31)35)16-21-23(28-13-10-15-34-18(3)4)29-24-19(5)11-9-14-30(24)25(21)32/h9,11,14,16,18,20,28H,6-8,10,12-13,15,17H2,1-5H3/b22-16-InChIKey
RFQPSQQCZLJAKI-JWGURIENSA-NSynonyms
835910-87-7(5Z)3(2ETHYLHEXYL)5((9METHYL4OXO2(3PROPAN2YLOXYPROPYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(2ethylhexyl)5((2((3isopropoxypropyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(2ethylhexyl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl2((3(propan2yloxy)propyl)amino)4Hpyrido(12a)pyrimidin4one
835910877
CCCCC(CC)CN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)NCCCOC(C)C)SC1=S
CCCCC(CN1C(=S)SC(=Cc2c(NCCCOC(C)C)nc3n(c2=O)cccc3C)C1=O)CC
InChI=1SC27H38N4O3S2c1681220(72)173126(33)22(3627(31)35)162123(281310153418(3)4)292419(5)1191430(24)25(21)32h9111416182028H681012131517H215H3b2216
MFCD03687292
ZINC000009461239
ZINC000009461240
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.