Vitas-M small molecule compound

(12aS)-2-(4-methoxybenzyl)-6-methyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL538065
SMILES COc1ccc(cc1)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2C)[nH]c2c1cccc2

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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 C23H23N3O3 MW 389.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O3/c1-14-22-18(17-5-3-4-6-19(17)24-22)11-20-23(28)25(13-21(27)26(14)20)12-15-7-9-16(29-2)10-8-15/h3-10,14,20,24H,11-13H2,1-2H3/t14?,20-/m0/s1
InChIKey
FKLAXTMGRBKEBZ-LGTGAQBVSA-N
Synonyms
956941-80-3
(12aS)2(4methoxybenzyl)6methyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)2(4methoxybenzyl)6methyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6((4methoxyphenyl)methyl)2methyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399435
956941803
COc1ccc(cc1)CN1CC(=O)N2(C@H)(C1=O)Cc1c(C2C)(nH)c2c1cccc2
InChI=1SC23H23N3O3c1142218(17534619(17)2422)112023(28)25(1321(27)26(14)20)12157916(292)10815h310142024H1113H212H3t14?20m0s1
MFCD04143685
ZINC000002155012
ZINC000002155014

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.