Vitas-M small molecule compound

N-(2-chloro-6-fluorobenzyl)-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide

Catalog ID
STL537419
SMILES COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCc1c(F)cccc1Cl

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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 C29H24ClFN4O4 MW 546.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24ClFN4O4/c1-29-25-17(19-14-16(39-2)10-11-23(19)33-25)12-13-34(29)28(38)35(27(29)37)24-9-4-3-6-18(24)26(36)32-15-20-21(30)7-5-8-22(20)31/h3-11,14,33H,12-13,15H2,1-2H3,(H,32,36)/t29-/m0/s1
InChIKey
KXWVICHVBIFHRO-LJAQVGFWSA-N
Synonyms
956210-73-4
(S)N(2chloro6fluorobenzyl)2(8methoxy11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)benzamide
~(N)((2chloro6fluorophenyl)methyl)2((2~(S))12methoxy2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)10(15)1113tetraen4yl)benzamide
6571126
956210734
COc1ccc2c(c1)c1CCN3(C@)(c1(nH)2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCc1c(F)cccc1Cl
InChI=1SC29H24ClFN4O4c1292517(191416(392)101123(19)3325)121334(29)28(38)35(27(29)37)24943618(24)26(36)32152021(30)75822(20)31h3111433H121315H212H3(H3236)t29m0s1
MFCD05671821
N(2chloro6fluorobenzyl)2((11bS)8methoxy11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)benzamide
ZINC000070687671
ZINC70687671

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.