Vitas-M small molecule compound
3-chloro-N-[3-(cyclopentylcarbamoyl)-4-ethyl-5-methylthiophen-2-yl]-4-fluoro-1-benzothiophene-2-carboxamide
Catalog ID
STK443148
SMILES CCc1c(C)sc(c1C(=O)NC1CCCC1)NC(=O)c1sc2c(c1Cl)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 C22H22ClFN2O2S2 MW 465.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClFN2O2S2/c1-3-13-11(2)29-22(16(13)20(27)25-12-7-4-5-8-12)26-21(28)19-18(23)17-14(24)9-6-10-15(17)30-19/h6,9-10,12H,3-5,7-8H2,1-2H3,(H,25,27)(H,26,28)InChIKey
KRUMWZZJGGHLTL-UHFFFAOYSA-NSynonyms
(2((3CHLORO4FLUOROBENZO(B)THIOPHEN2YL)CARBONYLAMINO)4ETHYL5METHYL(3THIENYL))NCYCLOPENTYLCARBOXAMIDE
3chloroN(3(cyclopentylcarbamoyl)4ethyl5methylthiophen2yl)4fluoro1benzothiophene2carboxamide
CCC1=C(SC(=C1C(=O)NC2CCCC2)NC(=O)C3=C(C4=C(C=CC=C4S3)F)Cl)C
InChI=1SC22H22ClFN2O2S2c131311(2)2922(16(13)20(27)2512745812)2621(28)1918(23)1714(24)961015(17)3019h691012H3578H212H3(H2527)(H2628)
MFCD04054655
ZINC000020191370
ZINC20191370
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