Vitas-M small molecule compound

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

Catalog ID
STK315433
SMILES CCCN1CC=C2C(C1)C(c1cccc(c1)C(F)(F)F)C(=C(C2(C#N)C#N)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/c1-2-7-30-8-6-18-17(11-30)19(14-4-3-5-15(9-14)22(23,24)25)16(10-26)20(29)21(18,12-27)13-28/h3-6,9,17,19H,2,7-8,11,29H2,1H3
InChIKey
PDFACFCEWVRGKX-UHFFFAOYSA-N
Synonyms

6amino2propyl8(3(trifluoromethyl)phenyl)1388atetrahydroisoquinoline557tricarbonitrile
6amino2propyl8(3(trifluoromethyl)phenyl)2388atetrahydroisoquinoline557(1H)tricarbonitrile
CCCN1CC=C2C(C1)C(C(=C(C2(C#N)C#N)N)C#N)C3=CC(=CC=C3)C(F)(F)F
InChI=1SC22H20F3N5c12730861817(1130)19(1443515(914)22(2324)25)16(1026)20(29)21(181227)1328h3691719H2781129H21H3
MFCD01243776
ZINC000019827451
ZINC000036042391

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Available files

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