Vitas-M small molecule compound
4-{[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]amino}benzoic acid
Catalog ID
STL396229
SMILES O=C(Cn1nc(c(c1C)Br)C)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 C14H14BrN3O3 MW 352.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14BrN3O3/c1-8-13(15)9(2)18(17-8)7-12(19)16-11-5-3-10(4-6-11)14(20)21/h3-6H,7H2,1-2H3,(H,16,19)(H,20,21)InChIKey
ZUJDLAQCQJOYRX-UHFFFAOYSA-NSynonyms
1005623-73-31005623733
4(((4BROMO35DIMETHYL1HPYRAZOL1YL)ACETYL)AMINO)BENZOICACID
4((2(4bromo35dimethylpyrazol1yl)acetyl)amino)benzoicacid
CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)C(=O)O)C)Br
InChI=1SC14H14BrN3O3c1813(15)9(2)18(178)712(19)16115310(4611)14(20)21h36H7H212H3(H1619)(H2021)
MFCD04137738
ZINC000002809227
ZINC2809227
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