Vitas-M small molecule compound
(2E)-1-(4-chloro-1-methyl-1H-pyrazol-3-yl)-3-{5-[(2,3-dihydro-1H-inden-5-yloxy)methyl]furan-2-yl}prop-2-en-1-one
Catalog ID
STK309506
SMILES Cn1nc(c(c1)Cl)C(=O)/C=C/c1ccc(o1)COc1ccc2c(c1)CCC2
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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 C21H19ClN2O3 MW 382.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O3/c1-24-12-19(22)21(23-24)20(25)10-9-16-7-8-18(27-16)13-26-17-6-5-14-3-2-4-15(14)11-17/h5-12H,2-4,13H2,1H3/b10-9+InChIKey
NOOIOZGTGYNQES-MDZDMXLPSA-NSynonyms
1005675-96-6(2E)1(4chloro1methyl1Hpyrazol3yl)3(5((23dihydro1Hinden5yloxy)methyl)furan2yl)prop2en1one
(E)1(4CHLORO1METHYLPYRAZOL3YL)3(5(23DIHYDRO1HINDEN5YLOXYMETHYL)FURAN2YL)PROP2EN1ONE
1005675966
CN1C=C(C(=N1)C(=O)C=CC2=CC=C(O2)COC3=CC4=C(CCC4)C=C3)Cl
Cn1nc(c(c1)Cl)C(=O)C=Cc1ccc(o1)COc1ccc2c(c1)CCC2
InChI=1SC21H19ClN2O3c1241219(22)21(2324)20(25)109167818(2716)132617651432415(14)1117h512H2413H21H3b109+
MFCD04051780
ZINC000006827991
ZINC06827991
ZINC6827991
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