Vitas-M small molecule compound
(12aS)-2-(2-methylpropyl)-6-(4-nitrophenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL528675
SMILES CC(CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)[N+](=O)[O-])[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 C24H24N4O4 MW 432.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N4O4/c1-14(2)12-26-13-21(29)27-20(24(26)30)11-18-17-5-3-4-6-19(17)25-22(18)23(27)15-7-9-16(10-8-15)28(31)32/h3-10,14,20,23,25H,11-13H2,1-2H3/t20-,23?/m0/s1InChIKey
IPESCDKHOHDSIF-AJZOCDQUSA-NSynonyms
956816-54-9(12aS)2(2methylpropyl)6(4nitrophenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2isobutyl6(4nitrophenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6(2methylpropyl)2(4nitrophenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16401042
956816549
CC(CN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccc(cc2)(N+)(=O)(O))(nH)c2c1cccc2)C
InChI=1SC24H24N4O4c114(2)12261321(29)2720(24(26)30)111817534619(17)2522(18)23(27)157916(10815)28(31)32h31014202325H1113H212H3t2023?m0s1
MFCD05672533
ZINC000002112717
ZINC000002112718
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