Vitas-M small molecule compound
(5E)-5-{1-[(1,3-benzodioxol-5-ylmethyl)amino]propylidene}-2,6-dihydroxypyrimidin-4(5H)-one
Catalog ID
STL050629
SMILES CC/C(=C\1/C(=NC(=NC1=O)O)O)/NCc1ccc2c(c1)OCO2
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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 C15H15N3O5 MW 317.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3O5/c1-2-9(12-13(19)17-15(21)18-14(12)20)16-6-8-3-4-10-11(5-8)23-7-22-10/h3-5,16H,2,6-7H2,1H3,(H2,17,18,19,20,21)InChIKey
ZIEDXZKNUDBEBO-UHFFFAOYSA-NSynonyms
(5E)5(1((13benzodioxol5ylmethyl)amino)propylidene)26dihydroxypyrimidin4(5H)one
5(1(13BENZODIOXOL5YLMETHYLAMINO)PROPYLIDENE)13DIAZINANE246TRIONE
CCC(=C1C(=NC(=NC1=O)O)O)NCc1ccc2c(c1)OCO2
CCC(=C1C(=O)NC(=O)NC1=O)NCC2=CC3=C(C=C2)OCO3
InChI=1SC15H15N3O5c129(1213(19)1715(21)1814(12)20)1668341011(58)2372210h3516H267H21H3(H21718192021)
MFCD05736866
ZINC000101086246
ZINC01277374
ZINC101086246
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