Vitas-M small molecule compound
(4Z)-4-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-5-methyl-2-(naphthalen-2-yl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK326641
SMILES CC1=NN(C(=O)/C/1=C\c1cc2OCOc2cc1Cl)c1ccc2c(c1)cccc2
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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 C22H15ClN2O3 MW 390.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClN2O3/c1-13-18(9-16-10-20-21(11-19(16)23)28-12-27-20)22(26)25(24-13)17-7-6-14-4-2-3-5-15(14)8-17/h2-11H,12H2,1H3/b18-9-InChIKey
KCVGIYPZPOWXIE-NVMNQCDNSA-NSynonyms
426247-63-4(4Z)4((6chloro13benzodioxol5yl)methylidene)5methyl2(naphthalen2yl)24dihydro3Hpyrazol3one
(4Z)4((6CHLORO13BENZODIOXOL5YL)METHYLIDENE)5METHYL2NAPHTHALEN2YLPYRAZOL3ONE
426247634
CC1=NN(C(=O)C1=Cc1cc2OCOc2cc1Cl)c1ccc2c(c1)cccc2
CC1=NN(C(=O)C1=CC2=CC3=C(C=C2Cl)OCO3)C4=CC5=CC=CC=C5C=C4
InChI=1SC22H15ClN2O3c11318(916102021(1119(16)23)28122720)22(26)25(2413)177614423515(14)817h211H12H21H3b189
MFCD01920924
ZINC000015015667
ZINC15015667
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