Vitas-M small molecule compound
4-{[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)butanoyl]amino}benzoic acid
Catalog ID
STL397223
SMILES CCC(n1nc(c(c1C)Cl)C)C(=O)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 C16H18ClN3O3 MW 335.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClN3O3/c1-4-13(20-10(3)14(17)9(2)19-20)15(21)18-12-7-5-11(6-8-12)16(22)23/h5-8,13H,4H2,1-3H3,(H,18,21)(H,22,23)InChIKey
UTFZCLYUSDOJRY-UHFFFAOYSA-NSynonyms
1005561-98-71005561987
4((2(4CHLORO35DIMETHYL1HPYRAZOL1YL)BUTANOYL)AMINO)BENZOICACID
4(2(4chloro35dimethylpyrazol1yl)butanoylamino)benzoicacid
CCC(C(=O)NC1=CC=C(C=C1)C(=O)O)N2C(=C(C(=N2)C)Cl)C
InChI=1SC16H18ClN3O3c1413(2010(3)14(17)9(2)1920)15(21)18127511(6812)16(22)23h5813H4H213H3(H1821)(H2223)
MFCD04140643
ZINC000002731467
ZINC000002731468
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