Vitas-M small molecule compound
4,4'-({3-[(4-chlorobenzyl)oxy]phenyl}methanediyl)bis(3-methyl-1H-pyrazol-5-ol)
Catalog ID
STK066301
SMILES Clc1ccc(cc1)COc1cccc(c1)C(c1c(O)[nH]nc1C)c1c(O)[nH]nc1C
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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 C22H21ClN4O3 MW 424.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN4O3/c1-12-18(21(28)26-24-12)20(19-13(2)25-27-22(19)29)15-4-3-5-17(10-15)30-11-14-6-8-16(23)9-7-14/h3-10,20H,11H2,1-2H3,(H2,24,26,28)(H2,25,27,29)InChIKey
XOHZLXCKDOICNT-UHFFFAOYSA-NSynonyms
4((3((4CHLOROBENZYL)OXY)PHENYL)(5HYDROXY3METHYL1HPYRAZOL4YL)METHYL)3METHYL1HPYRAZOL5OL
4((3((4CHLOROPHENYL)METHOXY)PHENYL)(3METHYL5OXO12DIHYDROPYRAZOL4YL)METHYL)5METHYL12DIHYDROPYRAZOL3ONE
44((3((4CHLOROBENZYL)OXY)PHENYL)METHANEDIYL)BIS(3METHYL1HPYRAZOL5OL)
CC1=C(C(=O)NN1)C(C2=CC(=CC=C2)OCC3=CC=C(C=C3)Cl)C4=C(NNC4=O)C
Clc1ccc(cc1)COc1cccc(c1)C(c1c(O)(nH)nc1C)c1c(O)(nH)nc1C
InChI=1SC22H21ClN4O3c11218(21(28)262412)20(1913(2)252722(19)29)1543517(1015)3011146816(23)9714h31020H11H212H3(H2242628)(H2252729)
MFCD03861831
STK066301
ZINC000008396401
ZINC08396401
ZINC8396401
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