Vitas-M small molecule compound
ethyl 2-{[3-(4-benzylpiperidin-1-yl)quinoxalin-2-yl]amino}-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK544944
SMILES CCOC(=O)c1c(Nc2nc3ccccc3nc2N2CCC(CC2)Cc2ccccc2)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 C29H32N4O2S MW 500.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O2S/c1-4-35-29(34)25-19(2)20(3)36-28(25)32-26-27(31-24-13-9-8-12-23(24)30-26)33-16-14-22(15-17-33)18-21-10-6-5-7-11-21/h5-13,22H,4,14-18H2,1-3H3,(H,30,32)InChIKey
HBIIPETUEOGAEH-UHFFFAOYSA-NSynonyms
497248-38-1497248381
CCOC(=O)C1=C(SC(=C1C)C)NC2=NC3=CC=CC=C3N=C2N4CCC(CC4)CC5=CC=CC=C5
ethyl2((3(4benzylpiperidin1yl)quinoxalin2yl)amino)45dimethylthiophene3carboxylate
InChI=1SC29H32N4O2Sc143529(34)2519(2)20(3)3628(25)322627(312413981223(24)3026)33161422(151733)1821106571121h51322H41418H213H3(H3032)
MFCD03298264
ZINC000012616098
ZINC12616098
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