Vitas-M small molecule compound
ethyl 1-{3-[1-cyano-2-oxo-2-(prop-2-en-1-ylamino)ethyl]quinoxalin-2-yl}piperidine-4-carboxylate
Catalog ID
STL240442
SMILES C=CCNC(=O)C(c1nc2ccccc2nc1N1CCC(CC1)C(=O)OCC)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 C22H25N5O3 MW 407.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O3/c1-3-11-24-21(28)16(14-23)19-20(26-18-8-6-5-7-17(18)25-19)27-12-9-15(10-13-27)22(29)30-4-2/h3,5-8,15-16H,1,4,9-13H2,2H3,(H,24,28)InChIKey
CEHLCZYUDBHVIG-UHFFFAOYSA-NSynonyms
381188-56-3381188563
CCOC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)NCC=C
ethyl1(3(1cyano2oxo2(prop2en1ylamino)ethyl)quinoxalin2yl)piperidine4carboxylate
ETHYL1(3(1CYANO2OXO2(PROP2ENYLAMINO)ETHYL)QUINOXALIN2YL)PIPERIDINE4CARBOXYLATE
ethyl1(3(2(allylamino)1cyano2oxoethyl)quinoxalin2yl)piperidine4carboxylate
InChI=1SC22H25N5O3c13112421(28)16(1423)1920(2618865717(18)2519)2712915(101327)22(29)3042h3581516H14913H22H3(H2428)
MFCD02993653
ZINC000004811589
ZINC000004811590
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