Vitas-M small molecule compound

ethyl 2-[(cyclohexylcarbonyl)amino]-5-[(2-fluorophenyl)carbamoyl]-4-methylthiophene-3-carboxylate

Catalog ID
STK073896
SMILES CCOC(=O)c1c(NC(=O)C2CCCCC2)sc(c1C)C(=O)Nc1ccccc1F

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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 C22H25FN2O4S MW 432.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25FN2O4S/c1-3-29-22(28)17-13(2)18(20(27)24-16-12-8-7-11-15(16)23)30-21(17)25-19(26)14-9-5-4-6-10-14/h7-8,11-12,14H,3-6,9-10H2,1-2H3,(H,24,27)(H,25,26)
InChIKey
LOBFPOUYPVQJDC-UHFFFAOYSA-N
Synonyms
312622-58-5
312622585
CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2F)NC(=O)C3CCCCC3
CCOC(=O)c1c(NC(=O)C2CCCCC2)sc(c1C)C(=O)Nc1ccccc1F
ETHYL2((CYCLOHEXYLCARBONYL)AMINO)5((2FLUOROPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2(CYCLOHEXANECARBONYLAMINO)5((2FLUOROPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC22H25FN2O4Sc132922(28)1713(2)18(20(27)241612871115(16)23)3021(17)2519(26)1495461014h78111214H36910H212H3(H2427)(H2526)
MFCD01825187
STK073896
ZINC000008843248
ZINC08843248
ZINC8843248

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Available files

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