Vitas-M small molecule compound

methyl 4,5-dimethyl-2-({[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]carbonyl}amino)thiophene-3-carboxylate

Catalog ID
STL399592
SMILES COC(=O)c1c(sc(c1C)C)NC(=O)c1cc(nn1C)C(F)(F)F

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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 C14H14F3N3O3S MW 361.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14F3N3O3S/c1-6-7(2)24-12(10(6)13(22)23-4)18-11(21)8-5-9(14(15,16)17)19-20(8)3/h5H,1-4H3,(H,18,21)
InChIKey
WMFNZHLCAOBRNH-UHFFFAOYSA-N
Synonyms
1005662-28-1
1005662281
CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=NN2C)C(F)(F)F)C
InChI=1SC14H14F3N3O3Sc167(2)2412(10(6)13(22)234)1811(21)859(14(1516)17)1920(8)3h5H14H3(H1821)
METHYL45DIMETHYL2(((1METHYL3(TRIFLUOROMETHYL)1HPYRAZOL5YL)CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
METHYL45DIMETHYL2((2METHYL5(TRIFLUOROMETHYL)PYRAZOLE3CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD04048753
ZINC000002747794
ZINC02747794
ZINC2747794

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Available files

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