Vitas-M small molecule compound

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

Catalog ID
STL533050
SMILES Clc1cccc(c1)C1N2[C@@H](Cc3c1[nH]c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)NCCc1ccccc1F

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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 C34H26ClFN4O3 MW 593.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H26ClFN4O3/c35-22-10-7-9-21(18-22)31-30-25(23-11-2-5-14-27(23)38-30)19-29-33(42)40(34(43)39(29)31)28-15-6-3-12-24(28)32(41)37-17-16-20-8-1-4-13-26(20)36/h1-15,18,29,31,38H,16-17,19H2,(H,37,41)/t29-,31?/m0/s1
InChIKey
AUFBKDBLAIVEEX-QHSFNAQHSA-N
Synonyms
956823-72-6
16405644
2((11aS)5(3chlorophenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)N(2fluorophenethyl)benzamide
2((11aS)5(3chlorophenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)N(2(2fluorophenyl)ethyl)benzamide
2((15~(S))10(3chlorophenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)~(N)(2(2fluorophenyl)ethyl)benzamide
956823726
Clc1cccc(c1)C1N2(C@@H)(Cc3c1(nH)c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)NCCc1ccccc1F
InChI=1SC34H26ClFN4O3c3522107921(1822)313025(2311251427(23)3830)192933(42)40(34(43)39(29)31)2815631224(28)32(41)371716208141326(20)36h11518293138H161719H2(H3741)t2931?m0s1
ZINC000070705254
ZINC000070705258

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Available files

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