Vitas-M small molecule compound
(8R,8aR)-6-amino-8-(2,3-dimethoxyphenyl)-2-methyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Catalog ID
STK544464
SMILES N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C)c1cccc(c1OC)OC)(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 C21H21N5O2 MW 375.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2/c1-26-8-7-13-15(9-22)20(25)21(11-23,12-24)18(16(13)10-26)14-5-4-6-17(27-2)19(14)28-3/h4-7,16,18H,8,10,25H2,1-3H3/t16-,18+/m0/s1InChIKey
UBLKAZBJUCENGO-FUHWJXTLSA-NSynonyms
488783-75-1(8R8aR)6amino8(23dimethoxyphenyl)2methyl1388atetrahydroisoquinoline577tricarbonitrile
(8R8aR)6amino8(23dimethoxyphenyl)2methyl2388atetrahydroisoquinoline577(1H)tricarbonitrile
488783751
CN1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=C(C(=CC=C3)OC)OC
InChI=1SC21H21N5O2c126871315(922)20(25)21(11231224)18(16(13)1026)1454617(272)19(14)283h471618H81025H213H3t1618+m0s1
MFCD18242152
N#CC1=C(N)C((C@@H)((C@@H)2C1=CCN(C2)C)c1cccc(c1OC)OC)(C#N)C#N
ZINC000019816355
ZINC19816355
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