Vitas-M small molecule compound
(8R,8aR)-6-amino-2-ethyl-8-(2-methoxyphenyl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Catalog ID
STK832899
SMILES CCN1CC=C2[C@H](C1)[C@@H](c1ccccc1OC)C(C(=C2C#N)N)(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 C21H21N5O MW 359.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O/c1-3-26-9-8-14-16(10-22)20(25)21(12-23,13-24)19(17(14)11-26)15-6-4-5-7-18(15)27-2/h4-8,17,19H,3,9,11,25H2,1-2H3/t17-,19+/m0/s1InChIKey
LGKACOQOJXRNEC-PKOBYXMFSA-NSynonyms
293751-79-8(8R8aR)6amino2ethyl8(2methoxyphenyl)1388atetrahydroisoquinoline577tricarbonitrile
(8R8aR)6amino2ethyl8(2methoxyphenyl)2388atetrahydroisoquinoline577(1H)tricarbonitrile
293751798
CCN1CC=C2(C@H)(C1)(C@@H)(c1ccccc1OC)C(C(=C2C#N)N)(C#N)C#N
CCN1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=CC=CC=C3OC
InChI=1SC21H21N5Oc1326981416(1022)20(25)21(12231324)19(17(14)1126)15645718(15)272h481719H391125H212H3t1719+m0s1
ZINC000004631478
ZINC04631478
ZINC4631478
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