Vitas-M small molecule compound
(8R,8aR)-6-amino-8-(2,3-dimethoxyphenyl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Catalog ID
STK539338
SMILES N#CC1=C(N)C([C@@H]([C@@H]2C1=CCNC2)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 C20H19N5O2 MW 361.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O2/c1-26-16-5-3-4-13(18(16)27-2)17-15-9-25-7-6-12(15)14(8-21)19(24)20(17,10-22)11-23/h3-6,15,17,25H,7,9,24H2,1-2H3/t15-,17+/m0/s1InChIKey
ZIUNGNSFWYVVBV-DOTOQJQBSA-NSynonyms
459153-37-8(8R8aR)6amino8(23dimethoxyphenyl)2388atetrahydro1Hisoquinoline577tricarbonitrile
(8R8aR)6amino8(23dimethoxyphenyl)2388atetrahydroisoquinoline577(1H)tricarbonitrile
459153378
COC1=CC=CC(=C1OC)C2C3CNCC=C3C(=C(C2(C#N)C#N)N)C#N
InChI=1SC20H19N5O2c1261653413(18(16)272)17159257612(15)14(821)19(24)20(171022)1123h36151725H7924H212H3t1517+m0s1
MFCD18241757
N#CC1=C(N)C((C@@H)((C@@H)2C1=CCNC2)c1cccc(c1OC)OC)(C#N)C#N
ZINC000019851771
ZINC19851771
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