Vitas-M small molecule compound
ethyl (1R,2R,3R)-1,6-dicyano-2-(4-methoxyphenyl)-3-[(4-methoxyphenyl)carbonyl]-1,2,3,8a-tetrahydroindolizine-1-carboxylate
Catalog ID
STK583809
SMILES CCOC(=O)[C@@]1(C#N)C2C=CC(=CN2[C@H]([C@@H]1c1ccc(cc1)OC)C(=O)c1ccc(cc1)OC)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 C28H25N3O5 MW 483.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O5/c1-4-36-27(33)28(17-30)23-14-5-18(15-29)16-31(23)25(24(28)19-6-10-21(34-2)11-7-19)26(32)20-8-12-22(35-3)13-9-20/h5-14,16,23-25H,4H2,1-3H3/t23?,24-,25+,28-/m0/s1InChIKey
QRONPCGXIRMSDP-ILAPFZNCSA-NSynonyms
1014001-84-3(1R2R3R)ethyl16dicyano3(4methoxybenzoyl)2(4methoxyphenyl)1238atetrahydroindolizine1carboxylate
1014001843
CCOC(=O)(C@@)1(C#N)C2C=CC(=CN2(C@H)((C@@H)1c1ccc(cc1)OC)C(=O)c1ccc(cc1)OC)C#N
CCOC(=O)C1(C2C=CC(=CN2C(C1C3=CC=C(C=C3)OC)C(=O)C4=CC=C(C=C4)OC)C#N)C#N
ethyl(1R2R3R)16dicyano2(4methoxyphenyl)3((4methoxyphenyl)carbonyl)1238atetrahydroindolizine1carboxylate
ethyl(1R2R3R)16dicyano3(4methoxybenzoyl)2(4methoxyphenyl)38adihydro2Hindolizine1carboxylate
InChI=1SC28H25N3O5c143627(33)28(1730)2314518(1529)1631(23)25(24(28)1961021(342)11719)26(32)2081222(353)13920h514162325H4H213H3t23?2425+28m0s1
MFCD18245731
ZINC000009233797
ZINC000009233799
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.