Vitas-M small molecule compound

2-[(11aS)-5-(3-methoxyphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]-N-(4-methylbenzyl)benzamide

Catalog ID
STL531643
SMILES COc1cccc(c1)C1N2[C@@H](Cc3c1[nH]c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)NCc1ccc(cc1)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 C35H30N4O4 MW 570.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H30N4O4/c1-21-14-16-22(17-15-21)20-36-33(40)26-11-4-6-13-29(26)39-34(41)30-19-27-25-10-3-5-12-28(25)37-31(27)32(38(30)35(39)42)23-8-7-9-24(18-23)43-2/h3-18,30,32,37H,19-20H2,1-2H3,(H,36,40)/t30-,32?/m0/s1
InChIKey
RWQAKRJFNLKPMJ-TZYYSAMKSA-N
Synonyms
956953-64-3
16402288
2((11aS)5(3methoxyphenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)N(4methylbenzyl)benzamide
2((11aS)5(3methoxyphenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)N(4methylbenzyl)benzamide
2((15~(S))10(3methoxyphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)~(N)((4methylphenyl)methyl)benzamide
956953643
COc1cccc(c1)C1N2(C@@H)(Cc3c1(nH)c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)NCc1ccc(cc1)C
InChI=1SC35H30N4O4c121141622(171521)203633(40)2611461329(26)3934(41)3019272510351228(25)3731(27)32(38(30)35(39)42)2387924(1823)432h318303237H1920H212H3(H3640)t3032?m0s1
MFCD06493326
ZINC000070692190
ZINC000070692191

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Available files

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