Vitas-M small molecule compound

6-amino-2-(propan-2-yl)-8-[2-(trifluoromethyl)phenyl]-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile

Catalog ID
STK748640
SMILES N#CC1=C(N)C(C(C2C1=CCN(C2)C(C)C)c1ccccc1C(F)(F)F)(C#N)C#N

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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 C22H20F3N5 MW 411.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20F3N5/c1-13(2)30-8-7-14-16(9-26)20(29)21(11-27,12-28)19(17(14)10-30)15-5-3-4-6-18(15)22(23,24)25/h3-7,13,17,19H,8,10,29H2,1-2H3
InChIKey
RSSXDRFOLCEQQP-UHFFFAOYSA-N
Synonyms
302901-74-2
302901742
6amino2(propan2yl)8(2(trifluoromethyl)phenyl)2388atetrahydroisoquinoline577(1H)tricarbonitrile
6amino2isopropyl8(2(trifluoromethyl)phenyl)2388atetrahydroisoquinoline577(1H)tricarbonitrile
6amino2propan2yl8(2(trifluoromethyl)phenyl)1388atetrahydroisoquinoline577tricarbonitrile
CC(C)N1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=CC=CC=C3C(F)(F)F
InChI=1SC22H20F3N5c113(2)30871416(926)20(29)21(11271228)19(17(14)1030)15534618(15)22(2324)25h37131719H81029H212H3
MFCD00743626
ZINC000005408149
ZINC000035126452

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Available files

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