Vitas-M small molecule compound

(4E)-2-(4-fluorophenyl)-5-propyl-4-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK766874
SMILES CCCC1=NN(C(=O)/C/1=C/NCC1CCCO1)c1ccc(cc1)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 C18H22FN3O2 MW 331.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22FN3O2/c1-2-4-17-16(12-20-11-15-5-3-10-24-15)18(23)22(21-17)14-8-6-13(19)7-9-14/h6-9,12,15,20H,2-5,10-11H2,1H3/b16-12+
InChIKey
CHPYWDOGDKGDCA-FOWTUZBSSA-N
Synonyms

(4E)2(4FLUOROPHENYL)4((OXOLAN2YLMETHYLAMINO)METHYLIDENE)5PROPYLPYRAZOL3ONE
(4E)2(4FLUOROPHENYL)5PROPYL4(((TETRAHYDRO2FURANYLMETHYL)AMINO)METHYLENE)24DIHYDRO3HPYRAZOL3ONE
(4E)2(4FLUOROPHENYL)5PROPYL4(((TETRAHYDROFURAN2YLMETHYL)AMINO)METHYLENE)24DIHYDRO3HPYRAZOL3ONE
(4E)2(4fluorophenyl)5propyl4(((tetrahydrofuran2ylmethyl)amino)methylidene)24dihydro3Hpyrazol3one
1(4FLUOROPHENYL)4(((OXOLAN2YLMETHYL)AMINO)METHYLENE)3PROPYL12DIAZOLIN5ONE
2(4FLUOROPHENYL)5PROPYL4(((TETRAHYDROFURAN2YLMETHYL)AMINO)METHYLENE)24DIHYDROPYRAZOL3ONE
CCCC1=NN(C(=O)C1=CNCC2CCCO2)C3=CC=C(C=C3)F
InChI=1SC18H22FN3O2c1241716(1220111553102415)18(23)22(2117)148613(19)7914h69121520H251011H21H3b1612+
MFCD03036370
ZINC000100111164
ZINC000100111167

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.