Vitas-M small molecule compound

8,9-dimethoxy-5,5-dimethyl-3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[3,4-a]isoquinoline

Catalog ID
STK830348
SMILES COc1cc2c(cc1OC)CC(n1c2nnc1C(F)(F)F)(C)C

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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 C15H16F3N3O2 MW 327.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16F3N3O2/c1-14(2)7-8-5-10(22-3)11(23-4)6-9(8)12-19-20-13(21(12)14)15(16,17)18/h5-6H,7H2,1-4H3
InChIKey
CKQWXCCIICBSLO-UHFFFAOYSA-N
Synonyms
296793-67-4
296793674
89dimethoxy55dimethyl3(trifluoromethyl)56dihydro(124)triazolo(34a)isoquinoline
89DIMETHOXY55DIMETHYL3(TRIFLUOROMETHYL)6H(124)TRIAZOLO(34A)ISOQUINOLINE
CC1(CC2=CC(=C(C=C2C3=NN=C(N31)C(F)(F)F)OC)OC)C
InChI=1SC15H16F3N3O2c114(2)78510(223)11(234)69(8)12192013(21(12)14)15(1617)18h56H7H214H3
MFCD01460929
ZINC000000554665
ZINC00554665
ZINC554665

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.