Vitas-M small molecule compound
(5E)-6-hydroxy-5-[({[4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-yl]methyl}amino)methylidene]-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Catalog ID
STK620457
SMILES COCCCN1C(=O)N=C(/C(=C\NCC2(CCOCC2)c2ccc(cc2)OC)/C1=O)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 C22H29N3O6 MW 431.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N3O6/c1-29-11-3-10-25-20(27)18(19(26)24-21(25)28)14-23-15-22(8-12-31-13-9-22)16-4-6-17(30-2)7-5-16/h4-7,14,23H,3,8-13,15H2,1-2H3,(H,24,26,28)/b18-14+InChIKey
RTWKNTOTIDIWST-NBVRZTHBSA-NSynonyms
(5E)5(((4(4methoxyphenyl)oxan4yl)methylamino)methylidene)1(3methoxypropyl)13diazinane246trione
(5E)6hydroxy5((((4(4methoxyphenyl)tetrahydro2Hpyran4yl)methyl)amino)methylidene)3(3methoxypropyl)pyrimidine24(3H5H)dione
COCCCN1C(=O)C(=CNCC2(CCOCC2)C3=CC=C(C=C3)OC)C(=O)NC1=O
COCCCN1C(=O)N=C(C(=CNCC2(CCOCC2)c2ccc(cc2)OC)C1=O)O
InChI=1SC22H29N3O6c129113102520(27)18(19(26)2421(25)28)14231522(8123113922)164617(302)7516h471423H381315H212H3(H242628)b1814+
MFCD09790554
ZINC000020625296
ZINC20625296
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