Vitas-M small molecule compound

(4Z)-2-(4-fluorophenyl)-4-{1-[(3-hydroxypropyl)amino]ethylidene}-5-(4-methoxyphenyl)-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK234810
SMILES OCCCN/C(=C\1/C(=NN(C1=O)c1ccc(cc1)F)c1ccc(cc1)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 C21H22FN3O3 MW 383.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FN3O3/c1-14(23-12-3-13-26)19-20(15-4-10-18(28-2)11-5-15)24-25(21(19)27)17-8-6-16(22)7-9-17/h4-11,23,26H,3,12-13H2,1-2H3/b19-14-
InChIKey
IOAFUNOOYZNCLL-RGEXLXHISA-N
Synonyms

(4Z)2(4fluorophenyl)4(1((3hydroxypropyl)amino)ethylidene)5(4methoxyphenyl)24dihydro3Hpyrazol3one
(4Z)2(4FLUOROPHENYL)4(1(3HYDROXYPROPYLAMINO)ETHYLIDENE)5(4METHOXYPHENYL)PYRAZOL3ONE
(Z)1(4fluorophenyl)4(1((3hydroxypropyl)amino)ethylidene)3(4methoxyphenyl)1Hpyrazol5(4H)one
1(4FLUOROPHENYL)4(((3HYDROXYPROPYL)AMINO)ETHYLIDENE)3(4METHOXYPHENYL)12DIAZOLIN5ONE
CC(=C1C(=NN(C1=O)C2=CC=C(C=C2)F)C3=CC=C(C=C3)OC)NCCCO
InChI=1SC21H22FN3O3c114(231231326)1920(1541018(282)11515)2425(21(19)27)178616(22)7917h4112326H31213H212H3b1914
MFCD07792775
OCCCNC(=C1C(=NN(C1=O)c1ccc(cc1)F)c1ccc(cc1)OC)C
ZINC000004999684
ZINC04999684
ZINC4999684

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Available files

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