Vitas-M small molecule compound

(12bS)-2-(4-fluorobenzyl)-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
STL527714
SMILES COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)Cc1ccc(cc1)F

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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 C23H22FN3O3 MW 407.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22FN3O3/c1-23-21-17(18-11-16(30-2)7-8-19(18)25-21)9-10-27(23)20(28)13-26(22(23)29)12-14-3-5-15(24)6-4-14/h3-8,11,25H,9-10,12-13H2,1-2H3/t23-/m0/s1
InChIKey
JXLWIYCUZMBFLL-QHCPKHFHSA-N
Synonyms
956987-88-5
(12bS)2(4fluorobenzyl)9methoxy12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(2~(S))4((4fluorophenyl)methyl)13methoxy2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)11(16)1214tetraene36dione
(S)2(4fluorobenzyl)9methoxy12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
6568062
956987885
COc1ccc2c(c1)c1CCN3(C@)(c1(nH)2)(C)C(=O)N(CC3=O)Cc1ccc(cc1)F
InChI=1SC23H22FN3O3c1232117(181116(302)7819(18)2521)91027(23)20(28)1326(22(23)29)12143515(24)6414h381125H9101213H212H3t23m0s1
MFCD03661936
ZINC000004044087
ZINC4044087

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Available files

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