Vitas-M small molecule compound

methyl 3-[(2,5-dimethylphenyl)sulfamoyl]-4-fluoro-1-benzothiophene-2-carboxylate

Catalog ID
STL095897
SMILES COC(=O)c1sc2c(c1S(=O)(=O)Nc1cc(C)ccc1C)c(F)ccc2

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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 C18H16FNO4S2 MW 393.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16FNO4S2/c1-10-7-8-11(2)13(9-10)20-26(22,23)17-15-12(19)5-4-6-14(15)25-16(17)18(21)24-3/h4-9,20H,1-3H3
InChIKey
QJVAVOKJUJKQHW-UHFFFAOYSA-N
Synonyms
932303-78-1
932303781
CC1=CC(=C(C=C1)C)NS(=O)(=O)C2=C(SC3=CC=CC(=C32)F)C(=O)OC
InChI=1SC18H16FNO4S2c1107811(2)13(910)2026(2223)171512(19)54614(15)2516(17)18(21)243h4920H13H3
METHYL3(((25DIMETHYLPHENYL)AMINO)SULFONYL)4FLUORO1BENZOTHIOPHENE2CARBOXYLATE
methyl3((25dimethylphenyl)sulfamoyl)4fluoro1benzothiophene2carboxylate
METHYL3(N(25DIMETHYLPHENYL)SULFAMOYL)4FLUOROBENZO(B)THIOPHENE2CARBOXYLATE
MFCD08540016
ZINC000007428273
ZINC07428273
ZINC7428273

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Available files

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