Vitas-M small molecule compound

ethyl 2-({N-[2-chloro-5-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycyl}amino)benzoate

Catalog ID
STL070511
SMILES CCOC(=O)c1ccccc1NC(=O)CN(S(=O)(=O)C)c1cc(ccc1Cl)C(F)(F)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 C19H18ClF3N2O5S MW 478.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClF3N2O5S/c1-3-30-18(27)13-6-4-5-7-15(13)24-17(26)11-25(31(2,28)29)16-10-12(19(21,22)23)8-9-14(16)20/h4-10H,3,11H2,1-2H3,(H,24,26)
InChIKey
JDABKQBDBQKSBX-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=CC=C1NC(=O)CN(C2=C(C=CC(=C2)C(F)(F)F)Cl)S(=O)(=O)C
ETHYL2((2(2CHLORONMETHYLSULFONYL5(TRIFLUOROMETHYL)ANILINO)ACETYL)AMINO)BENZOATE
ethyl2((N(2chloro5(trifluoromethyl)phenyl)N(methylsulfonyl)glycyl)amino)benzoate
InChI=1SC19H18ClF3N2O5Sc133018(27)13645715(13)2417(26)1125(31(228)29)161012(19(2122)23)8914(16)20h410H311H212H3(H2426)
MFCD03706332
ZINC000001150399
ZINC01150399
ZINC1150399

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Available files

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