Vitas-M small molecule compound

methyl 2-({N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(phenylsulfonyl)glycyl}amino)benzoate

Catalog ID
STL086367
SMILES COC(=O)c1ccccc1NC(=O)CN(S(=O)(=O)c1ccccc1)c1ccc(c(c1)C(F)(F)F)Cl

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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 C23H18ClF3N2O5S MW 526.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClF3N2O5S/c1-34-22(31)17-9-5-6-10-20(17)28-21(30)14-29(35(32,33)16-7-3-2-4-8-16)15-11-12-19(24)18(13-15)23(25,26)27/h2-13H,14H2,1H3,(H,28,30)
InChIKey
SMSJJJVWYRIUQB-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC(=C(C=C2)Cl)C(F)(F)F)S(=O)(=O)C3=CC=CC=C3
InChI=1SC23H18ClF3N2O5Sc13422(31)179561020(17)2821(30)1429(35(3233)167324816)15111219(24)18(1315)23(2526)27h213H14H21H3(H2830)
METHYL2((2(N(BENZENESULFONYL)4CHLORO3(TRIFLUOROMETHYL)ANILINO)ACETYL)AMINO)BENZOATE
methyl2((N(4chloro3(trifluoromethyl)phenyl)N(phenylsulfonyl)glycyl)amino)benzoate
MFCD02135341
ZINC000001208522
ZINC1208522

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Available files

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