Vitas-M small molecule compound

(2S)-N-(2-ethylhexyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]propanamide

Catalog ID
STL536660
SMILES CCCCC(CNC(=O)[C@@H](N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C)CC

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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 C25H34N4O3 MW 438.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H34N4O3/c1-5-7-10-17(6-2)15-26-22(30)16(3)29-23(31)25(4)21-19(13-14-28(25)24(29)32)18-11-8-9-12-20(18)27-21/h8-9,11-12,16-17,27H,5-7,10,13-15H2,1-4H3,(H,26,30)/t16-,17?,25-/m0/s1
InChIKey
HBPHGEOCKVHMIJ-CIYPRMSGSA-N
Synonyms
956913-02-3
(2~(S))~(N)(2ethylhexyl)2((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)propanamide
(2S)N(2ethylhexyl)2((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)propanamide
(2S)N(2ethylhexyl)2((S)11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)propanamide
16400139
956913023
CCCCC(CNC(=O)(C@@H)(N1C(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3)C)CC
InChI=1SC25H34N4O3c1571017(62)152622(30)16(3)2923(31)25(4)2119(131428(25)24(29)32)1811891220(18)2721h891112161727H57101315H214H3(H2630)t1617?25m0s1
ZINC000012863481
ZINC000012863488

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Available files

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