Vitas-M small molecule compound
ethyl (8S,8aR)-6-amino-5,7,7-tricyano-8-(4-methoxynaphthalen-1-yl)-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK999508
SMILES CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1ccc(c3c1cccc3)OC)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 C26H23N5O3 MW 453.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N5O3/c1-3-34-25(32)31-11-10-17-20(12-27)24(30)26(14-28,15-29)23(21(17)13-31)19-8-9-22(33-2)18-7-5-4-6-16(18)19/h4-10,21,23H,3,11,13,30H2,1-2H3/t21-,23+/m0/s1InChIKey
DYHASFVFIWHPPG-JTHBVZDNSA-NSynonyms
494792-35-7(8S8aR)ethyl6amino577tricyano8(4methoxynaphthalen1yl)1788atetrahydroisoquinoline2(3H)carboxylate
494792357
CCOC(=O)N1CC=C2(C@H)(C1)(C@@H)(c1ccc(c3c1cccc3)OC)C(C(=C2C#N)N)(C#N)C#N
CCOC(=O)N1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=CC=C(C4=CC=CC=C34)OC
ethyl(8S8aR)6amino577tricyano8(4methoxynaphthalen1yl)1388atetrahydroisoquinoline2carboxylate
ethyl(8S8aR)6amino577tricyano8(4methoxynaphthalen1yl)3788atetrahydroisoquinoline2(1H)carboxylate
InChI=1SC26H23N5O3c133425(32)3111101720(1227)24(30)26(14281529)23(21(17)1331)198922(332)18754616(18)19h4102123H3111330H212H3t2123+m0s1
ZINC000008441966
ZINC08441966
ZINC8441966
Check stock
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Check stock on Vitas-MAvailable files
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