Vitas-M small molecule compound
ethyl 2-{[N-(4-methylphenyl)-N-(methylsulfonyl)alanyl]amino}benzoate
Catalog ID
STL088943
SMILES CCOC(=O)c1ccccc1NC(=O)C(N(S(=O)(=O)C)c1ccc(cc1)C)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 C20H24N2O5S MW 404.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O5S/c1-5-27-20(24)17-8-6-7-9-18(17)21-19(23)15(3)22(28(4,25)26)16-12-10-14(2)11-13-16/h6-13,15H,5H2,1-4H3,(H,21,23)InChIKey
DYAJBXDRJOZDOA-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=CC=C1NC(=O)C(C)N(C2=CC=C(C=C2)C)S(=O)(=O)C
ethyl2((N(4methylphenyl)N(methylsulfonyl)alanyl)amino)benzoate
ETHYL2(2(4METHYLNMETHYLSULFONYLANILINO)PROPANOYLAMINO)BENZOATE
InChI=1SC20H24N2O5Sc152720(24)17867918(17)2119(23)15(3)22(28(425)26)16121014(2)111316h61315H5H214H3(H2123)
MFCD05814644
ZINC000001049381
ZINC000001049382
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