Vitas-M small molecule compound
2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-4-(4-methylbenzyl)-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK589381
SMILES Cc1ccc(cc1)Cc1c(C)[nH]n(c1=O)c1nc(C)cc(n1)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 C18H20N4O MW 308.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O/c1-11-5-7-15(8-6-11)10-16-14(4)21-22(17(16)23)18-19-12(2)9-13(3)20-18/h5-9,21H,10H2,1-4H3InChIKey
ULYANABFHGPNFF-UHFFFAOYSA-NSynonyms
890593-37-02(46DIMETHYLPYRIMIDIN2YL)5METHYL4((4METHYLPHENYL)METHYL)1HPYRAZOL3ONE
2(46dimethylpyrimidin2yl)5methyl4(4methylbenzyl)12dihydro3Hpyrazol3one
890593370
CC1=CC=C(C=C1)CC2=C(NN(C2=O)C3=NC(=CC(=N3)C)C)C
Cc1ccc(cc1)Cc1c(C)(nH)n(c1=O)c1nc(C)cc(n1)C
InChI=1SC18H20N4Oc1115715(8611)101614(4)2122(17(16)23)181912(2)913(3)2018h5921H10H214H3
MFCD18158358
ZINC000005321434
ZINC05321434
ZINC100129698
ZINC5321434
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