Vitas-M small molecule compound
[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl](3,4,5-triethoxyphenyl)methanone
Catalog ID
STK430813
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)N1N=C(CC1(O)C(F)F)C(F)F
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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 C18H22F4N2O5 MW 422.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22F4N2O5/c1-4-27-12-7-10(8-13(28-5-2)14(12)29-6-3)16(25)24-18(26,17(21)22)9-11(23-24)15(19)20/h7-8,15,17,26H,4-6,9H2,1-3H3InChIKey
RBMFWAMRUUQXLF-UHFFFAOYSA-NSynonyms
(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)(345triethoxyphenyl)methanone
(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)(345TRIETHOXYPHENYL)METHANONE
35BIS(DIFLUOROMETHYL)5HYDROXY(2PYRAZOLINYL)345TRIETHOXYPHENYLKETONE
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2C(CC(=N2)C(F)F)(C(F)F)O
InChI=1SC18H22F4N2O5c142712710(813(2852)14(12)2963)16(25)2418(2617(21)22)911(2324)15(19)20h78151726H469H213H3
MFCD03465733
ZINC000017092933
ZINC000017092934
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