Vitas-M small molecule compound
2-{[N-(3-chloro-2-methylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoic acid
Catalog ID
STK327695
SMILES O=C(CN(S(=O)(=O)C)c1cccc(c1C)Cl)Nc1ccccc1C(=O)O
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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 C17H17ClN2O5S MW 396.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN2O5S/c1-11-13(18)7-5-9-15(11)20(26(2,24)25)10-16(21)19-14-8-4-3-6-12(14)17(22)23/h3-9H,10H2,1-2H3,(H,19,21)(H,22,23)InChIKey
WKBVXASPZDDCLX-UHFFFAOYSA-NSynonyms
2((2(3CHLORO2METHYLNMETHYLSULFONYLANILINO)ACETYL)AMINO)BENZOICACID
2((N(3CHLORO2METHYLPHENYL)N(METHYLSULFONYL)GLYCYL)AMINO)BENZOICACID
CC1=C(C=CC=C1Cl)N(CC(=O)NC2=CC=CC=C2C(=O)O)S(=O)(=O)C
InChI=1SC17H17ClN2O5Sc11113(18)75915(11)20(26(224)25)1016(21)1914843612(14)17(22)23h39H10H212H3(H1921)(H2223)
MFCD03135566
ZINC000004019154
ZINC4019154
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