Vitas-M small molecule compound
9,10-dimethoxy-2-[3-(trifluoromethyl)phenoxy]-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
Catalog ID
STK571688
SMILES COc1cc2CCn3c(c2cc1OC)cc(nc3=O)Oc1cccc(c1)C(F)(F)F
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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 C21H17F3N2O4 MW 418.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17F3N2O4/c1-28-17-8-12-6-7-26-16(15(12)10-18(17)29-2)11-19(25-20(26)27)30-14-5-3-4-13(9-14)21(22,23)24/h3-5,8-11H,6-7H2,1-2H3InChIKey
IXPNFBDUGMWAJY-UHFFFAOYSA-NSynonyms
899394-28-6899394286
910dimethoxy2(3(trifluoromethyl)phenoxy)67dihydro4Hpyrimido(61a)isoquinolin4one
910DIMETHOXY2(3(TRIFLUOROMETHYL)PHENOXY)67DIHYDROPYRIMIDO(61A)ISOQUINOLIN4ONE
COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)OC4=CC=CC(=C4)C(F)(F)F)OC
InChI=1SC21H17F3N2O4c12817812672616(15(12)1018(17)292)1119(2520(26)27)301453413(914)21(2223)24h35811H67H212H3
MFCD06605464
ZINC000002324838
ZINC02324838
ZINC2324838
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