Vitas-M small molecule compound
9,10-dimethoxy-2-{[3-(trifluoromethyl)phenyl]amino}-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
Catalog ID
STL347933
SMILES COc1cc2CCn3c(c2cc1OC)cc(nc3=O)Nc1cccc(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 C21H18F3N3O3 MW 417.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18F3N3O3/c1-29-17-8-12-6-7-27-16(15(12)10-18(17)30-2)11-19(26-20(27)28)25-14-5-3-4-13(9-14)21(22,23)24/h3-5,8-11H,6-7H2,1-2H3,(H,25,26,28)InChIKey
SOCQMCMZBNFSPU-UHFFFAOYSA-NSynonyms
91209-99-3910dimethoxy2((3(trifluoromethyl)phenyl)amino)67dihydro4Hpyrimido(61a)isoquinolin4one
910DIMETHOXY2(3(TRIFLUOROMETHYL)ANILINO)67DIHYDROPYRIMIDO(61A)ISOQUINOLIN4ONE
91209993
COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)NC4=CC=CC(=C4)C(F)(F)F)OC
InChI=1SC21H18F3N3O3c12917812672716(15(12)1018(17)302)1119(2620(27)28)251453413(914)21(2223)24h35811H67H212H3(H252628)
MFCD05684990
ZINC000005478513
ZINC05478513
ZINC5478513
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