Vitas-M small molecule compound
dimethyl 2-({N-[2-chloro-5-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycyl}amino)benzene-1,4-dicarboxylate
Catalog ID
STL062071
SMILES COC(=O)c1ccc(cc1NC(=O)CN(S(=O)(=O)C)c1cc(ccc1Cl)C(F)(F)F)C(=O)OC
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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 C20H18ClF3N2O7S MW 522.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClF3N2O7S/c1-32-18(28)11-4-6-13(19(29)33-2)15(8-11)25-17(27)10-26(34(3,30)31)16-9-12(20(22,23)24)5-7-14(16)21/h4-9H,10H2,1-3H3,(H,25,27)InChIKey
WGKXYESEOJKYNP-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CN(C2=C(C=CC(=C2)C(F)(F)F)Cl)S(=O)(=O)C
DIMETHYL2((2(2CHLORONMETHYLSULFONYL5(TRIFLUOROMETHYL)ANILINO)ACETYL)AMINO)BENZENE14DICARBOXYLATE
dimethyl2((N(2chloro5(trifluoromethyl)phenyl)N(methylsulfonyl)glycyl)amino)benzene14dicarboxylate
InChI=1SC20H18ClF3N2O7Sc13218(28)114613(19(29)332)15(811)2517(27)1026(34(330)31)16912(20(2223)24)5714(16)21h49H10H213H3(H2527)
MFCD05989624
ZINC000001119200
ZINC1119200
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