Vitas-M small molecule compound

methyl 4-(4-methylphenyl)-3-{[3-(trifluoromethyl)phenyl]sulfamoyl}thiophene-2-carboxylate

Catalog ID
STL095737
SMILES COC(=O)c1scc(c1S(=O)(=O)Nc1cccc(c1)C(F)(F)F)c1ccc(cc1)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 C20H16F3NO4S2 MW 455.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16F3NO4S2/c1-12-6-8-13(9-7-12)16-11-29-17(19(25)28-2)18(16)30(26,27)24-15-5-3-4-14(10-15)20(21,22)23/h3-11,24H,1-2H3
InChIKey
FFMMLYHKQDPDTP-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)C2=CSC(=C2S(=O)(=O)NC3=CC=CC(=C3)C(F)(F)F)C(=O)OC
InChI=1SC20H16F3NO4S2c1126813(9712)16112917(19(25)282)18(16)30(2627)241553414(1015)20(2122)23h31124H12H3
METHYL4(4METHYLPHENYL)3(((3(TRIFLUOROMETHYL)PHENYL)AMINO)SULFONYL)THIOPHENE2CARBOXYLATE
methyl4(4methylphenyl)3((3(trifluoromethyl)phenyl)sulfamoyl)thiophene2carboxylate
MFCD09248831
ZINC000008604570
ZINC8604570

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.