Vitas-M small molecule compound

N-(3,4-dimethoxybenzyl)-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]benzamide

Catalog ID
STL536877
SMILES COc1cc(CNC(=O)c2ccccc2N2C(=O)N3[C@@](C2=O)(C)c2[nH]c4c(c2CC3)cccc4)ccc1OC

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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 C30H28N4O5 MW 524.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N4O5/c1-30-26-20(19-8-4-6-10-22(19)32-26)14-15-33(30)29(37)34(28(30)36)23-11-7-5-9-21(23)27(35)31-17-18-12-13-24(38-2)25(16-18)39-3/h4-13,16,32H,14-15,17H2,1-3H3,(H,31,35)/t30-/m0/s1
InChIKey
UGPQHUYVFSSPKI-PMERELPUSA-N
Synonyms
957023-01-7
(S)N(34dimethoxybenzyl)2(11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)benzamide
~(N)((34dimethoxyphenyl)methyl)2((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)benzamide
6570759
957023017
COc1cc(CNC(=O)c2ccccc2N2C(=O)N3(C@@)(C2=O)(C)c2(nH)c4c(c2CC3)cccc4)ccc1OC
InChI=1SC30H28N4O5c1302620(198461022(19)3226)141533(30)29(37)34(28(30)36)231175921(23)27(35)311718121324(382)25(1618)393h4131632H141517H213H3(H3135)t30m0s1
MFCD05671261
N(34dimethoxybenzyl)2((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)benzamide
ZINC000008918175
ZINC08918175

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Available files

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