Vitas-M small molecule compound
2-acetyl-6-amino-8-[2-(trifluoromethyl)phenyl]-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Catalog ID
STK748642
SMILES N#CC1=C(N)C(C(C2C1=CCN(C2)C(=O)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 C21H16F3N5O MW 411.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16F3N5O/c1-12(30)29-7-6-13-15(8-25)19(28)20(10-26,11-27)18(16(13)9-29)14-4-2-3-5-17(14)21(22,23)24/h2-6,16,18H,7,9,28H2,1H3InChIKey
MATZPHWGDLHZRY-UHFFFAOYSA-NSynonyms
293751-72-1293751721
2acetyl6amino8(2(trifluoromethyl)phenyl)1388atetrahydroisoquinoline577tricarbonitrile
2acetyl6amino8(2(trifluoromethyl)phenyl)2388atetrahydroisoquinoline577(1H)tricarbonitrile
CC(=O)N1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=CC=CC=C3C(F)(F)F
InChI=1SC21H16F3N5Oc112(30)29761315(825)19(28)20(10261127)18(16(13)929)14423517(14)21(2223)24h261618H7928H21H3
MFCD00743628
ZINC000000705916
ZINC000004115169
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