Vitas-M small molecule compound
(5Z)-1-(3-chloro-4-methoxyphenyl)-5-{[2,5-dimethyl-1-(naphthalen-2-yl)-1H-pyrrol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK553399
SMILES COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C/c2cc(n(c2C)c2ccc3c(c2)cccc3)C)/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 C28H22ClN3O4 MW 499.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22ClN3O4/c1-16-12-20(17(2)31(16)21-9-8-18-6-4-5-7-19(18)13-21)14-23-26(33)30-28(35)32(27(23)34)22-10-11-25(36-3)24(29)15-22/h4-15H,1-3H3,(H,30,33,35)/b23-14-InChIKey
ILRNIMWSJPPBCF-UCQKPKSFSA-NSynonyms
799785-56-1(5Z)1(3chloro4methoxyphenyl)5((25dimethyl1(naphthalen2yl)1Hpyrrol3yl)methylidene)pyrimidine246(1H3H5H)trione
(5Z)1(3CHLORO4METHOXYPHENYL)5((25DIMETHYL1NAPHTHALEN2YLPYRROL3YL)METHYLIDENE)13DIAZINANE246TRIONE
(Z)1(3chloro4methoxyphenyl)5((25dimethyl1(naphthalen2yl)1Hpyrrol3yl)methylene)pyrimidine246(1H3H5H)trione
799785561
CC1=CC(=C(N1C2=CC3=CC=CC=C3C=C2)C)C=C4C(=O)NC(=O)N(C4=O)C5=CC(=C(C=C5)OC)Cl
COc1ccc(cc1Cl)N1C(=O)NC(=O)C(=Cc2cc(n(c2C)c2ccc3c(c2)cccc3)C)C1=O
InChI=1SC28H22ClN3O4c1161220(17(2)31(16)219818645719(18)1321)142326(33)3028(35)32(27(23)34)22101125(363)24(29)1522h415H13H3(H303335)b2314
MFCD03675351
ZINC000008738154
ZINC8738154
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.