Vitas-M small molecule compound
7-benzyl-3-(2-hydroxyethyl)-8-methyl-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Catalog ID
STK978703
SMILES OCCN1CN(c2cccc(c2)C(F)(F)F)c2n(C1)c(=O)c(c(n2)C)Cc1ccccc1
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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 C23H23F3N4O2 MW 444.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23F3N4O2/c1-16-20(12-17-6-3-2-4-7-17)21(32)30-15-28(10-11-31)14-29(22(30)27-16)19-9-5-8-18(13-19)23(24,25)26/h2-9,13,31H,10-12,14-15H2,1H3InChIKey
OUPAUSSMKXXOJV-UHFFFAOYSA-NSynonyms
1158563-41-71158563417
7benzyl3(2hydroxyethyl)8methyl1(3(trifluoromethyl)phenyl)1234tetrahydro6Hpyrimido(12a)(135)triazin6one
7benzyl3(2hydroxyethyl)8methyl1(3(trifluoromethyl)phenyl)24dihydropyrimido(12a)(135)triazin6one
7benzyl3(2hydroxyethyl)8methyl1(3(trifluoromethyl)phenyl)34dihydro1Hpyrimido(12a)(135)triazin6(2H)one
CC1=C(C(=O)N2CN(CN(C2=N1)C3=CC=CC(=C3)C(F)(F)F)CCO)CC4=CC=CC=C4
InChI=1SC23H23F3N4O2c11620(12176324717)21(32)301528(101131)1429(22(30)2716)1995818(1319)23(2425)26h291331H10121415H21H3
MFCD13873400
ZINC000038830040
ZINC38830040
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