Vitas-M small molecule compound
(2E)-3-{5-[(4-chloro-3,5-dimethylphenoxy)methyl]furan-2-yl}-1-(1-methyl-1H-pyrazol-5-yl)prop-2-en-1-one
Catalog ID
STK307737
SMILES O=C(c1ccnn1C)/C=C/c1ccc(o1)COc1cc(C)c(c(c1)C)Cl
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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 C20H19ClN2O3 MW 370.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN2O3/c1-13-10-17(11-14(2)20(13)21)25-12-16-5-4-15(26-16)6-7-19(24)18-8-9-22-23(18)3/h4-11H,12H2,1-3H3/b7-6+InChIKey
PDKRHJYNHAJOEI-VOTSOKGWSA-NSynonyms
1005636-41-8(2E)3(5((4chloro35dimethylphenoxy)methyl)furan2yl)1(1methyl1Hpyrazol5yl)prop2en1one
(E)3(5((4CHLORO35DIMETHYLPHENOXY)METHYL)FURAN2YL)1(2METHYLPYRAZOL3YL)PROP2EN1ONE
1005636418
CC1=CC(=CC(=C1Cl)C)OCC2=CC=C(O2)C=CC(=O)C3=CC=NN3C
InChI=1SC20H19ClN2O3c1131017(1114(2)20(13)21)2512165415(2616)6719(24)18892223(18)3h411H12H213H3b76+
MFCD04131159
O=C(c1ccnn1C)C=Cc1ccc(o1)COc1cc(C)c(c(c1)C)Cl
ZINC000006922079
ZINC06922079
ZINC6922079
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