Vitas-M small molecule compound

methyl 3-[({1-[(2-chloro-6-fluorobenzyl)sulfonyl]piperidin-4-yl}carbonyl)amino]-4-methylbenzoate

Catalog ID
STL118089
SMILES COC(=O)c1ccc(c(c1)NC(=O)C1CCN(CC1)S(=O)(=O)Cc1c(F)cccc1Cl)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 C22H24ClFN2O5S MW 482.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClFN2O5S/c1-14-6-7-16(22(28)31-2)12-20(14)25-21(27)15-8-10-26(11-9-15)32(29,30)13-17-18(23)4-3-5-19(17)24/h3-7,12,15H,8-11,13H2,1-2H3,(H,25,27)
InChIKey
UZHRMKAXTVXYNV-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=CC=C3Cl)F
InChI=1SC22H24ClFN2O5Sc1146716(22(28)312)1220(14)2521(27)1581026(11915)32(2930)131718(23)43519(17)24h371215H81113H212H3(H2527)
methyl3(((1((2chloro6fluorobenzyl)sulfonyl)piperidin4yl)carbonyl)amino)4methylbenzoate
methyl3((1((2chloro6fluorophenyl)methylsulfonyl)piperidine4carbonyl)amino)4methylbenzoate
MFCD14824083
ZINC000024613661
ZINC24613661

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Available files

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