Vitas-M small molecule compound

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

Catalog ID
STL529007
SMILES COCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)[N+](=O)[O-])[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 C23H22N4O5 MW 434.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O5/c1-32-11-10-25-13-20(28)26-19(23(25)29)12-17-16-4-2-3-5-18(16)24-21(17)22(26)14-6-8-15(9-7-14)27(30)31/h2-9,19,22,24H,10-13H2,1H3/t19-,22?/m0/s1
InChIKey
UFVWGTSFJGDRKY-YDNXMHBPSA-N
Synonyms
956960-59-1
(12aS)2(2methoxyethyl)6(4nitrophenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)2(2methoxyethyl)6(4nitrophenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6(2methoxyethyl)2(4nitrophenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16401068
956960591
COCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccc(cc2)(N+)(=O)(O))(nH)c2c1cccc2
InChI=1SC23H22N4O5c1321110251320(28)2619(23(25)29)121716423518(16)2421(17)22(26)146815(9714)27(30)31h29192224H1013H21H3t1922?m0s1
MFCD05672649
ZINC000001901058
ZINC000001901060

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Available files

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