Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-7-[(3-ethoxy-4-methoxybenzyl)amino]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STL126627
SMILES CCOc1cc(CNc2ncc3c(n2)[nH]c(=O)n(c3=O)c2ccc3c(c2)OCO3)ccc1OC
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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 C23H21N5O6 MW 463.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N5O6/c1-3-32-18-8-13(4-6-16(18)31-2)10-24-22-25-11-15-20(26-22)27-23(30)28(21(15)29)14-5-7-17-19(9-14)34-12-33-17/h4-9,11H,3,10,12H2,1-2H3,(H2,24,25,26,27,30)InChIKey
MEJQRGOIKASFSD-UHFFFAOYSA-NSynonyms
3(13benzodioxol5yl)7((3ethoxy4methoxybenzyl)amino)pyrimido(45d)pyrimidine24(1H3H)dione
6(13benzodioxol5yl)2((3ethoxy4methoxyphenyl)methylamino)8Hpyrimido(45d)pyrimidine57dione
CCOC1=C(C=CC(=C1)CNC2=NC=C3C(=N2)NC(=O)N(C3=O)C4=CC5=C(C=C4)OCO5)OC
CCOc1cc(CNc2ncc3c(n2)(nH)c(=O)n(c3=O)c2ccc3c(c2)OCO3)ccc1OC
InChI=1SC23H21N5O6c133218813(4616(18)312)10242225111520(2622)2723(30)28(21(15)29)14571719(914)34123317h4911H31012H212H3(H22425262730)
MFCD20739256
ZINC000102911774
ZINC102911774
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