Vitas-M small molecule compound
2-[(3-ethoxypropyl)amino]-3-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STL363447
SMILES COCCCN1C(=S)S/C(=C\c2c(NCCCOCC)nc3n(c2=O)cccc3)/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 C21H26N4O4S2 MW 462.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O4S2/c1-3-29-13-6-9-22-18-15(19(26)24-10-5-4-8-17(24)23-18)14-16-20(27)25(21(30)31-16)11-7-12-28-2/h4-5,8,10,14,22H,3,6-7,9,11-13H2,1-2H3/b16-14-InChIKey
WNILLMSFDPSSJX-PEZBUJJGSA-NSynonyms
615279-42-0(5Z)5((2(3ETHOXYPROPYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(3METHOXYPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2((3ethoxypropyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(3methoxypropyl)2thioxothiazolidin4one
2((3ethoxypropyl)amino)3((Z)(3(3methoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
5((2((3ETHOXYPROPYL)AMINO)4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)3(3METHOXYPROPYL)2THIOXO13THIAZOLIDIN4ONE
615279420
CCOCCCNC1=C(C(=O)N2C=CC=CC2=N1)C=C3C(=O)N(C(=S)S3)CCCOC
COCCCN1C(=S)SC(=Cc2c(NCCCOCC)nc3n(c2=O)cccc3)C1=O
InChI=1SC21H26N4O4S2c13291369221815(19(26)241054817(24)2318)141620(27)25(21(30)3116)11712282h458101422H36791113H212H3b1614
MFCD03664117
ZINC000008858353
ZINC8858353
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.