Vitas-M small molecule compound

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

Catalog ID
STK089527
SMILES CCOC(=O)c1c(NC(=O)c2cccc(c2)F)sc(c1C)C(=O)Nc1ccc(cc1C)C

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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 C24H23FN2O4S MW 454.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23FN2O4S/c1-5-31-24(30)19-15(4)20(22(29)26-18-10-9-13(2)11-14(18)3)32-23(19)27-21(28)16-7-6-8-17(25)12-16/h6-12H,5H2,1-4H3,(H,26,29)(H,27,28)
InChIKey
NRUYFUMNEXIECI-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=C(C=C(C=C2)C)C)NC(=O)C3=CC(=CC=C3)F
CCOC(=O)c1c(NC(=O)c2cccc(c2)F)sc(c1C)C(=O)Nc1ccc(cc1C)C
ETHYL5((24DIMETHYLPHENYL)CARBAMOYL)2(((3FLUOROPHENYL)CARBONYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5((24DIMETHYLPHENYL)CARBAMOYL)2((3FLUOROBENZOYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5((24DIMETHYLPHENYL)CARBAMOYL)2(3FLUOROBENZAMIDO)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5(N(24DIMETHYLPHENYL)CARBAMOYL)2((3FLUOROPHENYL)CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC24H23FN2O4Sc153124(30)1915(4)20(22(29)261810913(2)1114(18)3)3223(19)2721(28)1676817(25)1216h612H5H214H3(H2629)(H2728)
MFCD02627425
STK089527
ZINC000000863431
ZINC00863431
ZINC863431

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Available files

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