Vitas-M small molecule compound

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

Catalog ID
STL530731
SMILES COc1ccc(cc1)C1N2C(=O)N(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)c1ccc(cc1)C(=O)NCc1ccccc1Cl

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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 C34H27ClN4O4 MW 591.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H27ClN4O4/c1-43-24-16-12-20(13-17-24)31-30-26(25-7-3-5-9-28(25)37-30)18-29-33(41)38(34(42)39(29)31)23-14-10-21(11-15-23)32(40)36-19-22-6-2-4-8-27(22)35/h2-17,29,31,37H,18-19H2,1H3,(H,36,40)/t29-,31?/m0/s1
InChIKey
HWQIIDWPKJFLKG-QHSFNAQHSA-N
Synonyms
956991-79-0
~(N)((2chlorophenyl)methyl)4((15~(S))10(4methoxyphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzamide
16406307
956991790
COc1ccc(cc1)C1N2C(=O)N(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)c1ccc(cc1)C(=O)NCc1ccccc1Cl
InChI=1SC34H27ClN4O4c14324161220(131724)313026(25735928(25)3730)182933(41)38(34(42)39(29)31)23141021(111523)32(40)361922624827(22)35h217293137H1819H21H3(H3640)t2931?m0s1
N(2chlorobenzyl)4((11aS)5(4methoxyphenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamide
N(2chlorobenzyl)4((11aS)5(4methoxyphenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)benzamide
ZINC000070707540
ZINC000070707544

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Available files

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