Vitas-M small molecule compound

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

Catalog ID
STL540133
SMILES CCC(N1CC(=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/c1-3-14(2)27-13-21(29)28-20(24(27)30)12-18-17-6-4-5-7-19(17)26-22(18)23(28)15-8-10-16(25)11-9-15/h4-11,14,20,23,26H,3,12-13H2,1-2H3/t14?,20-,23?/m0/s1
InChIKey
CDXWRRZCXWBXLB-UTHVCPNDSA-N
Synonyms
956990-81-1
(12aS)6(4bromophenyl)2(butan2yl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(4bromophenyl)2(secbutyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))2(4bromophenyl)6butan2yl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399480
956990811
CCC(N1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccc(cc2)Br)(nH)c2c1cccc2)C
InChI=1SC24H24BrN3O2c1314(2)271321(29)2820(24(27)30)121817645719(17)2622(18)23(28)1581016(25)11915h41114202326H31213H212H3t14?2023?m0s1
MFCD04143923
ZINC000002100351
ZINC000012662975

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Available files

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