Vitas-M small molecule compound

(12bS)-2-(1-benzylpiperidin-4-yl)-9-methoxy-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL537890
SMILES COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)C1CCN(CC1)Cc1ccccc1

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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 C28H32N4O3 MW 472.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O3/c1-28-26-22(23-16-21(35-2)8-9-24(23)29-26)12-15-32(28)25(33)18-31(27(28)34)20-10-13-30(14-11-20)17-19-6-4-3-5-7-19/h3-9,16,20,29H,10-15,17-18H2,1-2H3/t28-/m0/s1
InChIKey
HAHCJCWHECKHRL-NDEPHWFRSA-N
Synonyms
956795-57-6
(12bS)2(1benzylpiperidin4yl)9methoxy12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(2~(S))4(1benzylpiperidin4yl)13methoxy2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)11(16)1214tetraene36dione
(S)2(1benzylpiperidin4yl)9methoxy12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
6569207
956795576
COc1ccc2c(c1)c1CCN3(C@)(c1(nH)2)(C)C(=O)N(CC3=O)C1CCN(CC1)Cc1ccccc1
InChI=1SC28H32N4O3c1282622(231621(352)8924(23)2926)121532(28)25(33)1831(27(28)34)20101330(141120)17196435719h39162029H10151718H212H3t28m0s1
MFCD04143969
ZINC000008917760
ZINC8917760

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Available files

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