Vitas-M small molecule compound
(12aS)-2-(butan-2-yl)-6,6-dimethyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL526930
SMILES CCC(N1CC(=O)N2[C@H](C1=O)Cc1c(C2(C)C)[nH]c2c1cccc2)C
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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 C20H25N3O2 MW 339.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O2/c1-5-12(2)22-11-17(24)23-16(19(22)25)10-14-13-8-6-7-9-15(13)21-18(14)20(23,3)4/h6-9,12,16,21H,5,10-11H2,1-4H3/t12?,16-/m0/s1InChIKey
JXVKMIMOPKYYME-INSVYWFGSA-NSynonyms
956972-05-7(12aS)2(butan2yl)66dimethyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2(secbutyl)66dimethyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6butan2yl22dimethyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16397605
956972057
CCC(N1CC(=O)N2(C@H)(C1=O)Cc1c(C2(C)C)(nH)c2c1cccc2)C
InChI=1SC20H25N3O2c1512(2)221117(24)2316(19(22)25)101413867915(13)2118(14)20(233)4h69121621H51011H214H3t12?16m0s1
MFCD03266142
ZINC000004029668
ZINC000004029669
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