Vitas-M small molecule compound
4-[5-(2-chloro-6-methylquinolin-3-yl)-3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Catalog ID
STL336440
SMILES OC(=O)CCC(=O)N1N=C(CC1c1cc2cc(C)ccc2nc1Cl)c1ccco1
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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 C21H18ClN3O4 MW 411.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O4/c1-12-4-5-15-13(9-12)10-14(21(22)23-15)17-11-16(18-3-2-8-29-18)24-25(17)19(26)6-7-20(27)28/h2-5,8-10,17H,6-7,11H2,1H3,(H,27,28)InChIKey
YBRJNLACZKIOET-UHFFFAOYSA-NSynonyms
511237-81-34(3(2CHLORO6METHYLQUINOLIN3YL)5(FURAN2YL)34DIHYDROPYRAZOL2YL)4OXOBUTANOICACID
4(5(2chloro6methylquinolin3yl)3(furan2yl)45dihydro1Hpyrazol1yl)4oxobutanoicacid
511237813
CC1=CC2=CC(=C(N=C2C=C1)Cl)C3CC(=NN3C(=O)CCC(=O)O)C4=CC=CO4
InChI=1SC21H18ClN3O4c112451513(912)1014(21(22)2315)171116(183282918)2425(17)19(26)6720(27)28h2581017H6711H21H3(H2728)
MFCD03666123
ZINC000000798795
ZINC000000798796
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