Vitas-M small molecule compound

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

Catalog ID
STK317191
SMILES COC(=O)c1sccc1NC(=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 C12H10F3N3O3S MW 333.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10F3N3O3S/c1-18-7(5-8(17-18)12(13,14)15)10(19)16-6-3-4-22-9(6)11(20)21-2/h3-5H,1-2H3,(H,16,19)
InChIKey
PACMJHYHQNIHSX-UHFFFAOYSA-N
Synonyms
1005554-98-2
1005554982
CN1C(=CC(=N1)C(F)(F)F)C(=O)NC2=C(SC=C2)C(=O)OC
InChI=1SC12H10F3N3O3Sc1187(58(1718)12(1314)15)10(19)16634229(6)11(20)212h35H12H3(H1619)
methyl3(((1methyl3(trifluoromethyl)1Hpyrazol5yl)carbonyl)amino)thiophene2carboxylate
methyl3((2methyl5(trifluoromethyl)pyrazole3carbonyl)amino)thiophene2carboxylate
MFCD04047188
ZINC000002766993
ZINC02766993
ZINC2766993

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Available files

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