Vitas-M small molecule compound

6'-amino-2'-methyl-2-oxo-1,1',2,2',3',8a'-hexahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile

Catalog ID
STK669136
SMILES N#CC1=C(N)C(C2(C3C1=CCN(C3)C)C(=O)Nc1c2cccc1)(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 C20H16N6O MW 356.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N6O/c1-26-7-6-12-13(8-21)17(24)19(10-22,11-23)20(15(12)9-26)14-4-2-3-5-16(14)25-18(20)27/h2-6,15H,7,9,24H2,1H3,(H,25,27)
InChIKey
FZCZSLFFOZIVBY-UHFFFAOYSA-N
Synonyms

6amino2methyl2oxo112238ahexahydro7Hspiro(indole38isoquinoline)577tricarbonitrile
6amino2methyl2oxospiro(1Hindole3838adihydro1Hisoquinoline)577tricarbonitrile
CN1CC=C2C(C1)C3(C4=CC=CC=C4NC3=O)C(C(=C2C#N)N)(C#N)C#N
InChI=1SC20H16N6Oc126761213(821)17(24)19(10221123)20(15(12)926)14423516(14)2518(20)27h2615H7924H21H3(H2527)
MFCD00742720
ZINC000004115153
ZINC000014921442

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.