Vitas-M small molecule compound

ethyl 2-{[(4-chlorophenyl)carbonyl]amino}-5-[(2-fluorophenyl)carbamoyl]-4-methylthiophene-3-carboxylate

Catalog ID
STK065538
SMILES CCOC(=O)c1c(NC(=O)c2ccc(cc2)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 C22H18ClFN2O4S MW 460.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClFN2O4S/c1-3-30-22(29)17-12(2)18(20(28)25-16-7-5-4-6-15(16)24)31-21(17)26-19(27)13-8-10-14(23)11-9-13/h4-11H,3H2,1-2H3,(H,25,28)(H,26,27)
InChIKey
HDMWRFYEJYHIEV-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2F)NC(=O)C3=CC=C(C=C3)Cl
CCOC(=O)c1c(NC(=O)c2ccc(cc2)Cl)sc(c1C)C(=O)Nc1ccccc1F
ETHYL2(((4CHLOROPHENYL)CARBONYL)AMINO)5((2FLUOROPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2((4CHLOROBENZOYL)AMINO)5((2FLUOROANILINO)CARBONYL)4METHYL3THIOPHENECARBOXYLATE
ETHYL2((4CHLOROBENZOYL)AMINO)5((2FLUOROPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2((4CHLOROPHENYL)CARBONYLAMINO)5(N(2FLUOROPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC22H18ClFN2O4Sc133022(29)1712(2)18(20(28)2516754615(16)24)3121(17)2619(27)1381014(23)11913h411H3H212H3(H2528)(H2627)
MFCD01151556
STK065538
ZINC000000857110
ZINC00857110
ZINC857110

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Available files

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