Vitas-M small molecule compound

(12bR)-12b-methyl-2-{[(E)-(4-phenoxyphenyl)methylidene]amino}-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL537017
SMILES O=C1CN(/N=C/c2ccc(cc2)Oc2ccccc2)C(=O)[C@@]2(N1CCc1c2[nH]c2c1cccc2)C

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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 C28H24N4O3 MW 464.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O3/c1-28-26-23(22-9-5-6-10-24(22)30-26)15-16-31(28)25(33)18-32(27(28)34)29-17-19-11-13-21(14-12-19)35-20-7-3-2-4-8-20/h2-14,17,30H,15-16,18H2,1H3/b29-17+/t28-/m1/s1
InChIKey
IXWKIZOYGUXZIX-KUFLNJEKSA-N
Synonyms
956928-34-0
(12bR)12bmethyl2(((E)(4phenoxyphenyl)methylidene)amino)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(2~(R))2methyl4((~(E))(4phenoxyphenyl)methylideneamino)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
(RE)12bmethyl2((4phenoxybenzylidene)amino)2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
16399018
956928340
InChI=1SC28H24N4O3c1282623(229561024(22)3026)151631(28)25(33)1832(27(28)34)291719111321(141219)35207324820h2141730H151618H21H3b2917+t28m1s1
MFCD03853451
O=C1CN(N=Cc2ccc(cc2)Oc2ccccc2)C(=O)(C@@)2(N1CCc1c2(nH)c2c1cccc2)C
ZINC000012662034

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Available files

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