Vitas-M small molecule compound
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(2-methylbenzyl)-1H-pyrazol-4-yl]thiourea
Catalog ID
STL402820
SMILES S=C(Nc1ccc2c(c1)OCCO2)Nc1cnn(c1)Cc1ccccc1C
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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 C20H20N4O2S MW 380.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2S/c1-14-4-2-3-5-15(14)12-24-13-17(11-21-24)23-20(27)22-16-6-7-18-19(10-16)26-9-8-25-18/h2-7,10-11,13H,8-9,12H2,1H3,(H2,22,23,27)InChIKey
IEHOFYYOZMPAAR-UHFFFAOYSA-NSynonyms
1005623-48-21(23DIHYDRO14BENZODIOXIN6YL)3(1((2METHYLPHENYL)METHYL)PYRAZOL4YL)THIOUREA
1(23dihydro14benzodioxin6yl)3(1(2methylbenzyl)1Hpyrazol4yl)thiourea
1005623482
CC1=CC=CC=C1CN2C=C(C=N2)NC(=S)NC3=CC4=C(C=C3)OCCO4
InChI=1SC20H20N4O2Sc114423515(14)12241317(112124)2320(27)2216671819(1016)26982518h27101113H8912H21H3(H2222327)
MFCD04132854
ZINC000002798494
ZINC02798494
ZINC2798494
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