Vitas-M small molecule compound
(2S)-N-(4-fluorobenzyl)-4-methyl-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]pentanamide
Catalog ID
STL529316
SMILES Fc1ccc(cc1)CNC(=O)[C@@H](N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)CC(C)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 C27H29FN4O3 MW 476.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29FN4O3/c1-16(2)14-22(24(33)29-15-17-8-10-18(28)11-9-17)32-25(34)27(3)23-20(12-13-31(27)26(32)35)19-6-4-5-7-21(19)30-23/h4-11,16,22,30H,12-15H2,1-3H3,(H,29,33)/t22-,27-/m0/s1InChIKey
LSESJPWHEGWTRU-CUNXSJBXSA-NSynonyms
957010-12-7(2~(S))~(N)((4fluorophenyl)methyl)4methyl2((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)pentanamide
(2S)N(4fluorobenzyl)4methyl2((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)pentanamide
(S)N(4fluorobenzyl)4methyl2((S)11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)pentanamide
16402684
957010127
Fc1ccc(cc1)CNC(=O)(C@@H)(N1C(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3)CC(C)C
InChI=1SC27H29FN4O3c116(2)1422(24(33)29151781018(28)11917)3225(34)27(3)2320(121331(27)26(32)35)19645721(19)3023h411162230H1215H213H3(H2933)t2227m0s1
MFCD06494162
ZINC000008789022
ZINC8789022
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.