Vitas-M small molecule compound

(4aS,5R)-7-amino-2-(propan-2-yl)-5-(pyridin-3-yl)-3,4,4a,5-tetrahydroisoquinoline-6,6,8(2H)-tricarbonitrile

Catalog ID
STK525071
SMILES N#CC1=C(N)C([C@H]([C@H]2C1=CN(CC2)C(C)C)c1cccnc1)(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 C20H20N6 MW 344.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N6/c1-13(2)26-7-5-15-17(10-26)16(8-21)19(24)20(11-22,12-23)18(15)14-4-3-6-25-9-14/h3-4,6,9-10,13,15,18H,5,7,24H2,1-2H3/t15-,18+/m1/s1
InChIKey
MWJMUHAJNOJGGL-QAPCUYQASA-N
Synonyms
302777-08-8
(4aS5R)7amino2(propan2yl)5(pyridin3yl)344a5tetrahydroisoquinoline668(2H)tricarbonitrile
(4aS5R)7amino2isopropyl5(pyridin3yl)344a5tetrahydroisoquinoline668(2H)tricarbonitrile
(4AS5R)7AMINO2PROPAN2YL5PYRIDIN3YL344A5TETRAHYDROISOQUINOLINE668TRICARBONITRILE
302777088
CC(C)N1CCC2C(C(C(=C(C2=C1)C#N)N)(C#N)C#N)C3=CN=CC=C3
InChI=1SC20H20N6c113(2)26751517(1026)16(821)19(24)20(11221223)18(15)1443625914h346910131518H5724H212H3t1518+m1s1
N#CC1=C(N)C((C@H)((C@H)2C1=CN(CC2)C(C)C)c1cccnc1)(C#N)C#N
ZINC000004730280
ZINC04730280
ZINC4730280

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Available files

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