Vitas-M small molecule compound

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

Catalog ID
STK009192
SMILES CCOC(=O)c1c(NC(=O)C(C)(C)C)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 C20H23FN2O4S MW 406.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23FN2O4S/c1-6-27-18(25)14-11(2)15(28-17(14)23-19(26)20(3,4)5)16(24)22-13-10-8-7-9-12(13)21/h7-10H,6H2,1-5H3,(H,22,24)(H,23,26)
InChIKey
GPPCHKCTDAZWRS-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2F)NC(=O)C(C)(C)C
CCOC(=O)c1c(NC(=O)C(C)(C)C)sc(c1C)C(=O)Nc1ccccc1F
ETHYL2((22DIMETHYLPROPANOYL)AMINO)5((2FLUOROPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2(22DIMETHYLPROPANOYLAMINO)5((2FLUOROPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2(22DIMETHYLPROPANOYLAMINO)5(N(2FLUOROPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC20H23FN2O4Sc162718(25)1411(2)15(2817(14)2319(26)20(34)5)16(24)22131087912(13)21h710H6H215H3(H2224)(H2326)
MFCD01151600
STK009192
ZINC000002475568
ZINC02475568
ZINC2475568

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Available files

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