Vitas-M small molecule compound
[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]{1-[(2-nitrophenoxy)methyl]-1H-pyrazol-3-yl}methanone
Catalog ID
STK309652
SMILES FC(C1=NN(C(C1)(O)C(F)F)C(=O)c1ccn(n1)COc1ccccc1[N+](=O)[O-])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 C16H13F4N5O5 MW 431.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13F4N5O5/c17-13(18)10-7-16(27,15(19)20)24(22-10)14(26)9-5-6-23(21-9)8-30-12-4-2-1-3-11(12)25(28)29/h1-6,13,15,27H,7-8H2InChIKey
QFWZALJANXGKRD-UHFFFAOYSA-NSynonyms
1005590-23-7(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)(1((2nitrophenoxy)methyl)1Hpyrazol3yl)methanone
(35bis(difluoromethyl)5hydroxy4Hpyrazol1yl)(1((2nitrophenoxy)methyl)pyrazol3yl)methanone
1005590237
C1C(=NN(C1(C(F)F)O)C(=O)C2=NN(C=C2)COC3=CC=CC=C3(N+)(=O)(O))C(F)F
FC(C1=NN(C(C1)(O)C(F)F)C(=O)c1ccn(n1)COc1ccccc1(N+)(=O)(O))F
InChI=1SC16H13F4N5O5c1713(18)10716(2715(19)20)24(2210)14(26)95623(219)83012421311(12)25(28)29h16131527H78H2
MFCD04053398
ZINC000013960016
ZINC000013960017
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