Vitas-M small molecule compound

1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[3,5-dimethyl-1-(3-methylbenzyl)-1H-pyrazol-4-yl]urea

Catalog ID
STK487982
SMILES O=C(Nc1c(C)nn(c1C)Cc1cccc(c1)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/c1-14-5-4-6-17(11-14)13-26-16(3)21(15(2)25-26)24-22(27)23-18-7-8-19-20(12-18)29-10-9-28-19/h4-8,11-12H,9-10,13H2,1-3H3,(H2,23,24,27)
InChIKey
CZAFKIXBVFWSQB-UHFFFAOYSA-N
Synonyms

(2H3HBENZO(34E)14DIOXIN6YLAMINO)N(35DIMETHYL1((3METHYLPHENYL)METHYL)PYRAZOL4YL)CARBOXAMIDE
1(23dihydro14benzodioxin6yl)3(35dimethyl1((3methylphenyl)methyl)pyrazol4yl)urea
1(23dihydro14benzodioxin6yl)3(35dimethyl1(3methylbenzyl)1Hpyrazol4yl)urea
CC1=CC(=CC=C1)CN2C(=C(C(=N2)C)NC(=O)NC3=CC4=C(C=C3)OCCO4)C
InChI=1SC22H24N4O3c11454617(1114)132616(3)21(15(2)2526)2422(27)2318781920(1218)291092819h481112H91013H213H3(H2232427)
MFCD09423567
ZINC000013331654
ZINC13331654

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Available files

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