Vitas-M small molecule compound

di-tert-butyl 6-amino-5,7,7-tricyano-1,3,7,8a-tetrahydro-1'H,2H-spiro[isoquinoline-8,4'-piperidine]-1',2-dicarboxylate

Catalog ID
STK832999
SMILES N#CC1=C(N)C(C2(C3C1=CCN(C3)C(=O)OC(C)(C)C)CCN(CC2)C(=O)OC(C)(C)C)(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 C26H34N6O4 MW 494.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N6O4/c1-23(2,3)35-21(33)31-11-8-25(9-12-31)19-14-32(22(34)36-24(4,5)6)10-7-17(19)18(13-27)20(30)26(25,15-28)16-29/h7,19H,8-12,14,30H2,1-6H3
InChIKey
XXHBPYPJEOKCBZ-UHFFFAOYSA-N
Synonyms
302588-89-2
302588892
CC(C)(C)OC(=O)N1CCC2(CC1)C3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)C(=O)OC(C)(C)C
ditertbutyl6amino577tricyano1378atetrahydro1H2Hspiro(isoquinoline84piperidine)12dicarboxylate
ditertbutyl6amino577tricyano78adihydro1Hspiro(isoquinoline84piperidine)12(3H)dicarboxylate
DITERTBUTYL6AMINO577TRICYANOSPIRO(38ADIHYDRO1HISOQUINOLINE84PIPERIDINE)12DICARBOXYLATE
InChI=1SC26H34N6O4c123(23)3521(33)3111825(91231)191432(22(34)3624(45)6)10717(19)18(1327)20(30)26(251528)1629h719H8121430H216H3
ZINC000002278676
ZINC000002278677

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Available files

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