Vitas-M small molecule compound
ethyl 6-amino-5,5,7-tricyano-8-(pyridin-4-yl)-3,5,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK958037
SMILES CCOC(=O)N1CC=C2C(C1)C(c1ccncc1)C(=C(C2(C#N)C#N)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 C20H18N6O2 MW 374.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N6O2/c1-2-28-19(27)26-8-5-16-15(10-26)17(13-3-6-25-7-4-13)14(9-21)18(24)20(16,11-22)12-23/h3-7,15,17H,2,8,10,24H2,1H3InChIKey
IKPJXQGZGOLDGX-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CC=C2C(C1)C(C(=C(C2(C#N)C#N)N)C#N)C3=CC=NC=C3
ethyl6amino557tricyano8(pyridin4yl)3588atetrahydroisoquinoline2(1H)carboxylate
ethyl6amino557tricyano8pyridin4yl1388atetrahydroisoquinoline2carboxylate
InChI=1SC20H18N6O2c122819(27)26851615(1026)17(1336257413)14(921)18(24)20(161122)1223h371517H281024H21H3
MFCD01648155
ZINC000000668901
ZINC000000668910
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