Vitas-M small molecule compound

6-amino-8-(2-chloro-6-fluorophenyl)-2-propyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile

Catalog ID
STK539011
SMILES CCCN1CC=C2C(C1)C(c1c(F)cccc1Cl)C(C(=C2C#N)N)(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 C21H19ClFN5 MW 395.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClFN5/c1-2-7-28-8-6-13-14(9-24)20(27)21(11-25,12-26)19(15(13)10-28)18-16(22)4-3-5-17(18)23/h3-6,15,19H,2,7-8,10,27H2,1H3
InChIKey
VITDLNKSYWAGFK-UHFFFAOYSA-N
Synonyms
369404-19-3
369404193
6amino8(2chloro6fluorophenyl)2propyl1388atetrahydroisoquinoline577tricarbonitrile
6amino8(2chloro6fluorophenyl)2propyl2388atetrahydroisoquinoline577(1H)tricarbonitrile
CCCN1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=C(C=CC=C3Cl)F
InChI=1SC21H19ClFN5c12728861314(924)20(27)21(11251226)19(15(13)1028)1816(22)43517(18)23h361519H2781027H21H3
MFCD02949135
ZINC000000803579
ZINC000033936161

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Available files

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