Vitas-M small molecule compound
ethyl 1-{3-[2-(benzylamino)-1-cyano-2-oxoethyl]quinoxalin-2-yl}piperidine-3-carboxylate
Catalog ID
STL332983
SMILES CCOC(=O)C1CCCN(C1)c1nc2ccccc2nc1C(C(=O)NCc1ccccc1)C#N
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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 C26H27N5O3 MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O3/c1-2-34-26(33)19-11-8-14-31(17-19)24-23(29-21-12-6-7-13-22(21)30-24)20(15-27)25(32)28-16-18-9-4-3-5-10-18/h3-7,9-10,12-13,19-20H,2,8,11,14,16-17H2,1H3,(H,28,32)InChIKey
IUMXMQSPIMHHAM-UHFFFAOYSA-NSynonyms
384368-93-8(3S)ethyl1(3(2(benzylamino)1cyano2oxoethyl)quinoxalin2yl)piperidine3carboxylate
1(3(1CYANO2OXO2((PHENYLMETHYL)AMINO)ETHYL)2QUINOXALINYL)3PIPERIDINECARBOXYLICACIDETHYLESTER
1(3(2(BENZYLAMINO)1CYANO2KETOETHYL)QUINOXALIN2YL)NIPECOTICACIDETHYLESTER
384368938
CCOC(=O)C1CCCN(C1)C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)NCC4=CC=CC=C4
ETHYL1(3(1CYANO2OXIDANYLIDENE2((PHENYLMETHYL)AMINO)ETHYL)QUINOXALIN2YL)PIPERIDINE3CARBOXYLATE
ethyl1(3(2(benzylamino)1cyano2oxoethyl)quinoxalin2yl)piperidine3carboxylate
InChI=1SC26H27N5O3c123426(33)191181431(1719)2423(292112671322(21)3024)20(1527)25(32)28161894351018h3791012131920H2811141617H21H3(H2832)
MFCD03284769
ZINC000004327838
ZINC000102689066
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.