Vitas-M small molecule compound
(4Z)-4-(4-tert-butylbenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK177940
SMILES CC1=NN(C(=O)/C/1=C\c1ccc(cc1)C(C)(C)C)c1ccccc1
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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 C21H22N2O MW 318.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O/c1-15-19(14-16-10-12-17(13-11-16)21(2,3)4)20(24)23(22-15)18-8-6-5-7-9-18/h5-14H,1-4H3/b19-14-InChIKey
DRQRHXFJVQLESL-RGEXLXHISA-NSynonyms
(4Z)4((4TERTBUTYLPHENYL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
(4Z)4(4TERTBUTYLBENZYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
CC1=NN(C(=O)C1=Cc1ccc(cc1)C(C)(C)C)c1ccccc1
CC1=NN(C(=O)C1=CC2=CC=C(C=C2)C(C)(C)C)C3=CC=CC=C3
InChI=1SC21H22N2Oc11519(1416101217(131116)21(23)4)20(24)23(2215)188657918h514H14H3b1914
MFCD03272906
ZINC000014011437
ZINC14011437
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