Vitas-M small molecule compound
(5Z)-2-hydroxy-5-(1-{[2-(morpholin-4-ium-4-yl)ethyl]amino}ethylidene)-6-oxo-5,6-dihydropyrimidin-4-olate
Catalog ID
STL042609
SMILES OC1=NC(=O)/C(=C(\NCC[NH+]2CCOCC2)/C)/C(=N1)[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 C12H18N4O4 MW 282.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N4O4/c1-8(9-10(17)14-12(19)15-11(9)18)13-2-3-16-4-6-20-7-5-16/h13H,2-7H2,1H3,(H2,14,15,17,18,19)InChIKey
WRJJWAKQXVQTNI-UHFFFAOYSA-NSynonyms
(5E)5(1(2MORPHOLIN4IUM4YLETHYLAMINO)ETHYLIDENE)46DIOXO1HPYRIMIDIN2OLATE
(5Z)2hydroxy5(1((2(morpholin4ium4yl)ethyl)amino)ethylidene)6oxo56dihydropyrimidin4olate
5(1(2MORPHOLIN4IUM4YLETHYLAMINO)ETHYLIDENE)46DIOXO1HPYRIMIDIN2OLATE
5(1(2MORPHOLIN4YLETHYLAMINO)ETHYLIDENE)13DIAZINANE246TRIONE
CC(=C1C(=O)NC(=NC1=O)(O))NCC(NH+)2CCOCC2
InChI=1SC12H18N4O4c18(910(17)1412(19)1511(9)18)13231646207516h13H27H21H3(H21415171819)
MFCD18248172
OC1=NC(=O)C(=C(NCC(NH+)2CCOCC2)C)C(=N1)(O)
ZINC000001301908
ZINC1301908
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