Vitas-M small molecule compound

methyl 5-benzyl-2-{[(2-chloro-6-fluorophenyl)carbonyl]amino}thiophene-3-carboxylate

Catalog ID
STK427195
SMILES COC(=O)c1cc(sc1NC(=O)c1c(F)cccc1Cl)Cc1ccccc1

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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 C20H15ClFNO3S MW 403.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClFNO3S/c1-26-20(25)14-11-13(10-12-6-3-2-4-7-12)27-19(14)23-18(24)17-15(21)8-5-9-16(17)22/h2-9,11H,10H2,1H3,(H,23,24)
InChIKey
CHKVTALCGQFPQN-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=O)C3=C(C=CC=C3Cl)F
InChI=1SC20H15ClFNO3Sc12620(25)141113(10126324712)2719(14)2318(24)1715(21)85916(17)22h2911H10H21H3(H2324)
METHYL2((6CHLORO2FLUOROPHENYL)CARBONYLAMINO)5BENZYLTHIOPHENE3CARBOXYLATE
methyl5benzyl2(((2chloro6fluorophenyl)carbonyl)amino)thiophene3carboxylate
METHYL5BENZYL2((2CHLORO6FLUOROBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD02612287
ZINC000002782946
ZINC02782946
ZINC2782946

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Available files

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