Vitas-M small molecule compound

(12bR)-2-{[(E)-(3-chlorophenyl)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
STL537498
SMILES Clc1cccc(c1)/C=N/N1CC(=O)N2[C@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3

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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 C22H19ClN4O2 MW 406.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O2/c1-22-20-17(16-7-2-3-8-18(16)25-20)9-10-26(22)19(28)13-27(21(22)29)24-12-14-5-4-6-15(23)11-14/h2-8,11-12,25H,9-10,13H2,1H3/b24-12+/t22-/m1/s1
InChIKey
XBQPKSCVILVWBU-XUHCNCODSA-N
Synonyms
956527-68-7
(12bR)2(((E)(3chlorophenyl)methylidene)amino)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(2~(R))4((~(E))(3chlorophenyl)methylideneamino)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
(RE)2((3chlorobenzylidene)amino)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
956527687
9692023
Clc1cccc(c1)C=NN1CC(=O)N2(C@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3
InChI=1SC22H19ClN4O2c1222017(16723818(16)2520)91026(22)19(28)1327(21(22)29)24121454615(23)1114h28111225H91013H21H3b2412+t22m1s1
MFCD03850663
ZINC000004045071

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Available files

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