Vitas-M small molecule compound
4-({[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]acetyl}amino)benzoic acid
Catalog ID
STL400464
SMILES O=C(Cn1nc(cc1C)C(F)F)Nc1ccc(cc1)C(=O)O
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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 C14H13F2N3O3 MW 309.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13F2N3O3/c1-8-6-11(13(15)16)18-19(8)7-12(20)17-10-4-2-9(3-5-10)14(21)22/h2-6,13H,7H2,1H3,(H,17,20)(H,21,22)InChIKey
DNSKFISWGVKAOH-UHFFFAOYSA-NSynonyms
1005574-29-71005574297
4(((3(difluoromethyl)5methyl1Hpyrazol1yl)acetyl)amino)benzoicacid
4((2(3(difluoromethyl)5methylpyrazol1yl)acetyl)amino)benzoicacid
CC1=CC(=NN1CC(=O)NC2=CC=C(C=C2)C(=O)O)C(F)F
InChI=1SC14H13F2N3O3c18611(13(15)16)1819(8)712(20)1710429(3510)14(21)22h2613H7H21H3(H1720)(H2122)
MFCD05667917
ZINC000002767780
ZINC2767780
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