Vitas-M small molecule compound
2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl 3-[(3,4-dimethylphenyl)sulfonyl]propanoate
Catalog ID
STK265589
SMILES O=C(CCS(=O)(=O)c1ccc(c(c1)C)C)OCC(=O)Nc1ccc(c(c1)Cl)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 C20H22ClNO5S MW 423.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClNO5S/c1-13-5-7-17(10-15(13)3)28(25,26)9-8-20(24)27-12-19(23)22-16-6-4-14(2)18(21)11-16/h4-7,10-11H,8-9,12H2,1-3H3,(H,22,23)InChIKey
PNPJDFSDKSHKJV-UHFFFAOYSA-NSynonyms
(2(3chloro4methylanilino)2oxoethyl)3(34dimethylphenyl)sulfonylpropanoate
2((3chloro4methylphenyl)amino)2oxoethyl3((34dimethylphenyl)sulfonyl)propanoate
CC1=C(C=C(C=C1)S(=O)(=O)CCC(=O)OCC(=O)NC2=CC(=C(C=C2)C)Cl)C
InChI=1SC20H22ClNO5Sc1135717(1015(13)3)28(2526)9820(24)271219(23)22166414(2)18(21)1116h471011H8912H213H3(H2223)
MFCD06756248
ZINC000009525834
ZINC09525834
ZINC9525834
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