Vitas-M small molecule compound
(4Z)-4-(5-chloro-2-methoxybenzylidene)-5-methyl-2-(naphthalen-2-yl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK980214
SMILES COc1ccc(cc1/C=C\1/C(=NN(C1=O)c1ccc2c(c1)cccc2)C)Cl
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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 C22H17ClN2O2 MW 376.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClN2O2/c1-14-20(13-17-11-18(23)8-10-21(17)27-2)22(26)25(24-14)19-9-7-15-5-3-4-6-16(15)12-19/h3-13H,1-2H3/b20-13-InChIKey
UKMHOWOLNPUOON-MOSHPQCFSA-NSynonyms
(4Z)4((5CHLORO2METHOXYPHENYL)METHYLIDENE)5METHYL2NAPHTHALEN2YLPYRAZOL3ONE
(4Z)4(5chloro2methoxybenzylidene)5methyl2(naphthalen2yl)24dihydro3Hpyrazol3one
CC1=NN(C(=O)C1=CC2=C(C=CC(=C2)Cl)OC)C3=CC4=CC=CC=C4C=C3
COc1ccc(cc1C=C1C(=NN(C1=O)c1ccc2c(c1)cccc2)C)Cl
InChI=1SC22H17ClN2O2c11420(13171118(23)81021(17)272)22(26)25(2414)199715534616(15)1219h313H12H3b2013
MFCD03718187
ZINC000015016442
ZINC15016442
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