Vitas-M small molecule compound
(12bR)-2-{[(E)-(5-bromo-2-hydroxyphenyl)methylidene]amino}-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL538068
SMILES Brc1ccc(c(c1)/C=N/N1CC(=O)N2[C@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)O
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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 C22H19BrN4O3 MW 467.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19BrN4O3/c1-22-20-16(15-4-2-3-5-17(15)25-20)8-9-26(22)19(29)12-27(21(22)30)24-11-13-10-14(23)6-7-18(13)28/h2-7,10-11,25,28H,8-9,12H2,1H3/b24-11+/t22-/m1/s1InChIKey
RMIOLDQXUWXCFY-IBYPTGSDSA-NSynonyms
(12bR)2(((E)(5bromo2hydroxyphenyl)methylidene)amino)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(2~(R))4((~(E))(5bromo2hydroxyphenyl)methylideneamino)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
(RE)2((5bromo2hydroxybenzylidene)amino)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
135623759
Brc1ccc(c(c1)C=NN1CC(=O)N2(C@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3)O
InChI=1SC22H19BrN4O3c1222016(15423517(15)2520)8926(22)19(29)1227(21(22)30)2411131014(23)6718(13)28h2710112528H8912H21H3b2411+t22m1s1
MFCD03851636
ZINC000012661802
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