Vitas-M small molecule compound

(2R)-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]-2-(4-{[(1S)-2-oxocyclopentyl]methyl}phenyl)propanamide

Catalog ID
STL539353
SMILES O=C([C@@H](c1ccc(cc1)C[C@@H]1CCCC1=O)C)NC[C@@H]1CCCN2[C@@H]1CCCC2

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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 C25H36N2O2 MW 396.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36N2O2/c1-18(20-12-10-19(11-13-20)16-21-6-4-9-24(21)28)25(29)26-17-22-7-5-15-27-14-3-2-8-23(22)27/h10-13,18,21-23H,2-9,14-17H2,1H3,(H,26,29)/t18-,21+,22+,23-/m1/s1
InChIKey
XNSUPKAJFXOXLL-HGSOSGBHSA-N
Synonyms
1574408-61-9
(2~(R))~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)2(4(((1~(S))2oxocyclopentyl)methyl)phenyl)propanamide
(2R)N((1S9aR)octahydro2Hquinolizin1ylmethyl)2(4(((1S)2oxocyclopentyl)methyl)phenyl)propanamide
(R)N(((1S9aR)octahydro1Hquinolizin1yl)methyl)2(4(((S)2oxocyclopentyl)methyl)phenyl)propanamide
1574408619
71827231
InChI=1SC25H36N2O2c118(20121019(111320)162164924(21)28)25(29)2617227515271432823(22)27h1013182123H291417H21H3(H2629)t1821+22+23m1s1
O=C((C@@H)(c1ccc(cc1)C(C@@H)1CCCC1=O)C)NC(C@@H)1CCCN2(C@@H)1CCCC2
ZINC000096113979
ZINC96113979

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Available files

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