Vitas-M small molecule compound
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[3,5-dimethyl-1-(4-methylbenzyl)-1H-pyrazol-4-yl]urea
Catalog ID
STK482469
SMILES O=C(Nc1c(C)nn(c1C)Cc1ccc(cc1)C)Nc1ccc2c(c1)OCCO2
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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 C22H24N4O3 MW 392.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O3/c1-14-4-6-17(7-5-14)13-26-16(3)21(15(2)25-26)24-22(27)23-18-8-9-19-20(12-18)29-11-10-28-19/h4-9,12H,10-11,13H2,1-3H3,(H2,23,24,27)InChIKey
PFHCLKGEQJUPEZ-UHFFFAOYSA-NSynonyms
(2H3HBENZO(34E)14DIOXIN6YLAMINO)N(35DIMETHYL1((4METHYLPHENYL)METHYL)PYRAZOL4YL)CARBOXAMIDE
1(23dihydro14benzodioxin6yl)3(35dimethyl1((4methylphenyl)methyl)pyrazol4yl)urea
1(23dihydro14benzodioxin6yl)3(35dimethyl1(4methylbenzyl)1Hpyrazol4yl)urea
CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)NC(=O)NC3=CC4=C(C=C3)OCCO4)C
InChI=1SC22H24N4O3c1144617(7514)132616(3)21(15(2)2526)2422(27)2318891920(1218)2911102819h4912H101113H213H3(H2232427)
MFCD08569914
ZINC000013322689
ZINC13322689
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