Vitas-M small molecule compound

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

Catalog ID
STK830347
SMILES Cc1cc2CC(C)(C)n3c(c2cc1C)nnc3C(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 C15H16F3N3 MW 295.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16F3N3/c1-8-5-10-7-14(3,4)21-12(11(10)6-9(8)2)19-20-13(21)15(16,17)18/h5-6H,7H2,1-4H3
InChIKey
UXCZHLYXJLQZJH-UHFFFAOYSA-N
Synonyms
332413-30-6
332413306
5589tetramethyl3(trifluoromethyl)56dihydro(124)triazolo(34a)isoquinoline
5589tetramethyl3(trifluoromethyl)6H(124)triazolo(34a)isoquinoline
CC1=C(C=C2C(=C1)CC(N3C2=NN=C3C(F)(F)F)(C)C)C
InChI=1SC15H16F3N3c18510714(34)2112(11(10)69(8)2)192013(21)15(1617)18h56H7H214H3
MFCD00593348
ZINC000000104147
ZINC00104147
ZINC104147

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Available files

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