Vitas-M small molecule compound

ethyl 2-{[3-(4-ethylpiperazin-1-yl)quinoxalin-2-yl]amino}-4,5-dimethylthiophene-3-carboxylate

Catalog ID
STK544441
SMILES CCOC(=O)c1c(Nc2nc3ccccc3nc2N2CCN(CC2)CC)sc(c1C)C

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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 C23H29N5O2S MW 439.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N5O2S/c1-5-27-11-13-28(14-12-27)21-20(24-17-9-7-8-10-18(17)25-21)26-22-19(23(29)30-6-2)15(3)16(4)31-22/h7-10H,5-6,11-14H2,1-4H3,(H,24,26)
InChIKey
GMYSOIARCOSTDT-UHFFFAOYSA-N
Synonyms
489441-70-5
489441705
CCN1CCN(CC1)C2=NC3=CC=CC=C3N=C2NC4=C(C(=C(S4)C)C)C(=O)OCC
ethyl2((3(4ethylpiperazin1yl)quinoxalin2yl)amino)45dimethylthiophene3carboxylate
InChI=1SC23H29N5O2Sc1527111328(141227)2120(24179781018(17)2521)262219(23(29)3062)15(3)16(4)3122h710H561114H214H3(H2426)
MFCD03297217
ZINC000013584475
ZINC13584475

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Available files

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