Vitas-M small molecule compound
methyl [(4Z)-1-(4-fluorophenyl)-4-{1-[(3-hydroxypropyl)amino]ethylidene}-5-oxo-4,5-dihydro-1H-pyrazol-3-yl]acetate
Catalog ID
STK231968
SMILES OCCCN/C(=C\1/C(=NN(C1=O)c1ccc(cc1)F)CC(=O)OC)/C
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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 C17H20FN3O4 MW 349.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20FN3O4/c1-11(19-8-3-9-22)16-14(10-15(23)25-2)20-21(17(16)24)13-6-4-12(18)5-7-13/h4-7,19,22H,3,8-10H2,1-2H3/b16-11-InChIKey
NXLPHJFYRFLNLK-WJDWOHSUSA-NSynonyms
CC(=C1C(=NN(C1=O)C2=CC=C(C=C2)F)CC(=O)OC)NCCCO
InChI=1SC17H20FN3O4c111(1983922)1614(1015(23)252)2021(17(16)24)136412(18)5713h471922H3810H212H3b1611
methyl((4Z)1(4fluorophenyl)4(1((3hydroxypropyl)amino)ethylidene)5oxo45dihydro1Hpyrazol3yl)acetate
METHYL2((4Z)1(4FLUOROPHENYL)4(1(3HYDROXYPROPYLAMINO)ETHYLIDENE)5OXOPYRAZOL3YL)ACETATE
METHYL2(1(4FLUOROPHENYL)4(((3HYDROXYPROPYL)AMINO)ETHYLIDENE)5OXO12DIAZOLIN3YL)ACETATE
MFCD07597688
OCCCNC(=C1C(=NN(C1=O)c1ccc(cc1)F)CC(=O)OC)C
ZINC000004736908
ZINC04736908
ZINC4736908
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