Vitas-M small molecule compound
(4Z)-4-[2-(heptyloxy)benzylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK140371
SMILES CCCCCCCOc1ccccc1/C=C\1/C(=NN(C1=O)c1ccccc1)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 C24H28N2O2 MW 376.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O2/c1-3-4-5-6-12-17-28-23-16-11-10-13-20(23)18-22-19(2)25-26(24(22)27)21-14-8-7-9-15-21/h7-11,13-16,18H,3-6,12,17H2,1-2H3/b22-18-InChIKey
XDRTVYHPNWZRGA-PYCFMQQDSA-NSynonyms
(4Z)4((2heptoxyphenyl)methylidene)5methyl2phenylpyrazol3one
(4Z)4(2(HEPTYLOXY)BENZYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
CCCCCCCOC1=CC=CC=C1C=C2C(=NN(C2=O)C3=CC=CC=C3)C
CCCCCCCOc1ccccc1C=C1C(=NN(C1=O)c1ccccc1)C
InChI=1SC24H28N2O2c13456121728231611101320(23)182219(2)2526(24(22)27)21148791521h711131618H361217H212H3b2218
MFCD03240507
ZINC000097960140
ZINC97960140
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