Vitas-M small molecule compound
(12aS)-6-(4-nitrophenyl)-2-propyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL529138
SMILES CCCN1CC(=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 C23H22N4O4 MW 418.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O4/c1-2-11-25-13-20(28)26-19(23(25)29)12-17-16-5-3-4-6-18(16)24-21(17)22(26)14-7-9-15(10-8-14)27(30)31/h3-10,19,22,24H,2,11-13H2,1H3/t19-,22?/m0/s1InChIKey
REMYJTVERZBCDJ-YDNXMHBPSA-NSynonyms
956955-60-5(12aS)6(4nitrophenyl)2propyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6(4nitrophenyl)2propyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))2(4nitrophenyl)6propyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16401047
956955605
CCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccc(cc2)(N+)(=O)(O))(nH)c2c1cccc2
InChI=1SC23H22N4O4c1211251320(28)2619(23(25)29)121716534618(16)2421(17)22(26)147915(10814)27(30)31h310192224H21113H21H3t1922?m0s1
MFCD05672568
ZINC000001898334
ZINC000001898336
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