Vitas-M small molecule compound
methyl 3-{[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl}-4-fluoro-1-benzothiophene-2-carboxylate
Catalog ID
STL095933
SMILES COC(=O)c1sc2c(c1S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl)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 C20H18ClFN2O4S2 MW 468.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClFN2O4S2/c1-28-20(25)18-19(17-15(22)3-2-4-16(17)29-18)30(26,27)24-11-9-23(10-12-24)14-7-5-13(21)6-8-14/h2-8H,9-12H2,1H3InChIKey
WGXKQTUKPJEOKR-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C2=C(C=CC=C2S1)F)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)Cl
InChI=1SC20H18ClFN2O4S2c12820(25)1819(1715(22)32416(17)2918)30(2627)2411923(101224)147513(21)6814h28H912H21H3
methyl3((4(4chlorophenyl)piperazin1yl)sulfonyl)4fluoro1benzothiophene2carboxylate
METHYL3((4(4CHLOROPHENYL)PIPERAZIN1YL)SULFONYL)4FLUOROBENZO(B)THIOPHENE2CARBOXYLATE
methyl3(4(4chlorophenyl)piperazin1yl)sulfonyl4fluoro1benzothiophene2carboxylate
MFCD09248932
ZINC000012414331
ZINC12414331
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