Vitas-M small molecule compound
(12aS)-2-{[(E)-(3-bromophenyl)methylidene]amino}-6,6-dimethyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537620
SMILES Brc1cccc(c1)/C=N/N1CC(=O)N2[C@H](C1=O)Cc1c(C2(C)C)[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 C23H21BrN4O2 MW 465.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrN4O2/c1-23(2)21-17(16-8-3-4-9-18(16)26-21)11-19-22(30)27(13-20(29)28(19)23)25-12-14-6-5-7-15(24)10-14/h3-10,12,19,26H,11,13H2,1-2H3/b25-12+/t19-/m0/s1InChIKey
SAHJHYWZQWBHEE-BPDXMKQKSA-NSynonyms
956974-41-7(12aS)2(((E)(3bromophenyl)methylidene)amino)66dimethyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6((~(E))(3bromophenyl)methylideneamino)22dimethyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
(SE)2((3bromobenzylidene)amino)66dimethyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
16399525
956974417
Brc1cccc(c1)C=NN1CC(=O)N2(C@H)(C1=O)Cc1c(C2(C)C)(nH)c2c1cccc2
InChI=1SC23H21BrN4O2c123(2)2117(16834918(16)2621)111922(30)27(1320(29)28(19)23)25121465715(24)1014h310121926H1113H212H3b2512+t19m0s1
MFCD04144185
ZINC000002155718
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