Vitas-M small molecule compound

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

Catalog ID
STL541594
SMILES CC(CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)Br)[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 C24H24BrN3O2 MW 466.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24BrN3O2/c1-14(2)12-27-13-21(29)28-20(24(27)30)11-18-17-5-3-4-6-19(17)26-22(18)23(28)15-7-9-16(25)10-8-15/h3-10,14,20,23,26H,11-13H2,1-2H3/t20-,23?/m0/s1
InChIKey
XFPMHMVBFIZTRX-AJZOCDQUSA-N
Synonyms
956914-44-6
(12aS)6(4bromophenyl)2(2methylpropyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(4bromophenyl)2isobutyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))2(4bromophenyl)6(2methylpropyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16401778
956914446
CC(CN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccc(cc2)Br)(nH)c2c1cccc2)C
InChI=1SC24H24BrN3O2c114(2)12271321(29)2820(24(27)30)111817534619(17)2622(18)23(28)157916(25)10815h31014202326H1113H212H3t2023?m0s1
MFCD05676478
ZINC000002123420
ZINC000002123421

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Available files

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