Vitas-M small molecule compound
methyl 4-fluoro-3-{[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl}-1-benzothiophene-2-carboxylate
Catalog ID
STL095927
SMILES COc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1c(sc2c1c(F)ccc2)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 C21H21FN2O5S2 MW 464.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN2O5S2/c1-28-15-8-6-14(7-9-15)23-10-12-24(13-11-23)31(26,27)20-18-16(22)4-3-5-17(18)30-19(20)21(25)29-2/h3-9H,10-13H2,1-2H3InChIKey
PIJONNANFKMCGI-UHFFFAOYSA-NSynonyms
941962-35-2941962352
COC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=C(SC4=CC=CC(=C43)F)C(=O)OC
InChI=1SC21H21FN2O5S2c128158614(7915)23101224(131123)31(2627)201816(22)43517(18)3019(20)21(25)292h39H1013H212H3
methyl4fluoro3((4(4methoxyphenyl)piperazin1yl)sulfonyl)1benzothiophene2carboxylate
METHYL4FLUORO3((4(4METHOXYPHENYL)PIPERAZIN1YL)SULFONYL)BENZO(B)THIOPHENE2CARBOXYLATE
methyl4fluoro3(4(4methoxyphenyl)piperazin1yl)sulfonyl1benzothiophene2carboxylate
MFCD09248928
ZINC000012414328
ZINC12414328
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