Vitas-M small molecule compound

ethyl 2-{[(2,4-dichlorophenoxy)acetyl]amino}-5-[(2-fluorophenyl)carbamoyl]-4-methylthiophene-3-carboxylate

Catalog ID
STK065612
SMILES CCOC(=O)c1c(NC(=O)COc2ccc(cc2Cl)Cl)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 C23H19Cl2FN2O5S MW 525.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19Cl2FN2O5S/c1-3-32-23(31)19-12(2)20(21(30)27-16-7-5-4-6-15(16)26)34-22(19)28-18(29)11-33-17-9-8-13(24)10-14(17)25/h4-10H,3,11H2,1-2H3,(H,27,30)(H,28,29)
InChIKey
NNMMXIKHNWSZCG-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2F)NC(=O)COC3=C(C=C(C=C3)Cl)Cl
CCOC(=O)c1c(NC(=O)COc2ccc(cc2Cl)Cl)sc(c1C)C(=O)Nc1ccccc1F
ETHYL2(((24DICHLOROPHENOXY)ACETYL)AMINO)5((2FLUOROPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2((2(24DICHLOROPHENOXY)ACETYL)AMINO)5((2FLUOROPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2(2(24DICHLOROPHENOXY)ACETYLAMINO)5(N(2FLUOROPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC23H19Cl2FN2O5Sc133223(31)1912(2)20(21(30)2716754615(16)26)3422(19)2818(29)1133179813(24)1014(17)25h410H311H212H3(H2730)(H2829)
MFCD02104475
STK065612
ZINC000002784293
ZINC2784293

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Available files

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