Vitas-M small molecule compound
(5Z)-1-(2-ethylphenyl)-5-[(6-methoxy-1,3-benzodioxol-5-yl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK110218
SMILES COc1cc2OCOc2cc1/C=C\1/C(=O)NC(=O)N(C1=O)c1ccccc1CC
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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 C21H18N2O6 MW 394.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O6/c1-3-12-6-4-5-7-15(12)23-20(25)14(19(24)22-21(23)26)8-13-9-17-18(29-11-28-17)10-16(13)27-2/h4-10H,3,11H2,1-2H3,(H,22,24,26)/b14-8-InChIKey
FCOXWOSKWXBGFB-ZSOIEALJSA-NSynonyms
(5Z)1(2ETHYLPHENYL)5((6METHOXY13BENZODIOXOL5YL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(2ETHYLPHENYL)5((6METHOXY13BENZODIOXOL5YL)METHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CCC1=CC=CC=C1N2C(=O)C(=CC3=CC4=C(C=C3OC)OCO4)C(=O)NC2=O
COc1cc2OCOc2cc1C=C1C(=O)NC(=O)N(C1=O)c1ccccc1CC
InChI=1SC21H18N2O6c1312645715(12)2320(25)14(19(24)2221(23)26)81391718(29112817)1016(13)272h410H311H212H3(H222426)b148
MFCD03721693
ZINC000004680557
ZINC04680557
ZINC4680557
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