Vitas-M small molecule compound

methyl 4-({N-[(4-chlorophenyl)sulfonyl]-N-(4-fluorobenzyl)glycyl}amino)benzoate

Catalog ID
STK000080
SMILES COC(=O)c1ccc(cc1)NC(=O)CN(S(=O)(=O)c1ccc(cc1)Cl)Cc1ccc(cc1)F

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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 C23H20ClFN2O5S MW 490.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClFN2O5S/c1-32-23(29)17-4-10-20(11-5-17)26-22(28)15-27(14-16-2-8-19(25)9-3-16)33(30,31)21-12-6-18(24)7-13-21/h2-13H,14-15H2,1H3,(H,26,28)
InChIKey
CYXCXMYVJMAUMB-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)NC(=O)CN(CC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(C=C3)Cl
COC(=O)c1ccc(cc1)NC(=O)CN(S(=O)(=O)c1ccc(cc1)Cl)Cc1ccc(cc1)F
InChI=1SC23H20ClFN2O5Sc13223(29)1741020(11517)2622(28)1527(14162819(25)9316)33(3031)2112618(24)71321h213H1415H21H3(H2628)
METHYL4((2((4CHLOROPHENYL)SULFONYL((4FLUOROPHENYL)METHYL)AMINO)ACETYL)AMINO)BENZOATE
METHYL4((N((4CHLOROPHENYL)SULFONYL)N(4FLUOROBENZYL)GLYCYL)AMINO)BENZOATE
MFCD03715153
STK000080
ZINC000001137204
ZINC01137204
ZINC1137204

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Available files

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