Vitas-M small molecule compound
1-(1,3-benzodioxol-5-yl)-3-[4-bromo-1-(3,4-dichlorobenzyl)-1H-pyrazol-3-yl]urea
Catalog ID
STK458671
SMILES O=C(Nc1nn(cc1Br)Cc1ccc(c(c1)Cl)Cl)Nc1ccc2c(c1)OCO2
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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 C18H13BrCl2N4O3 MW 484.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13BrCl2N4O3/c19-12-8-25(7-10-1-3-13(20)14(21)5-10)24-17(12)23-18(26)22-11-2-4-15-16(6-11)28-9-27-15/h1-6,8H,7,9H2,(H2,22,23,24,26)InChIKey
DMNKXGNUFZYKTR-UHFFFAOYSA-NSynonyms
(2HBENZO(34D)13DIOXOLAN5YLAMINO)N(1((34DICHLOROPHENYL)METHYL)4BROMOPYRAZOL3YL)CARBOXAMIDE
1(13BENZODIOXOL5YL)3(4BROMO1((34DICHLOROPHENYL)METHYL)PYRAZOL3YL)UREA
1(13benzodioxol5yl)3(4bromo1(34dichlorobenzyl)1Hpyrazol3yl)urea
C1OC2=C(O1)C=C(C=C2)NC(=O)NC3=NN(C=C3Br)CC4=CC(=C(C=C4)Cl)Cl
InChI=1SC18H13BrCl2N4O3c1912825(7101313(20)14(21)510)2417(12)2318(26)2211241516(611)2892715h168H79H2(H222232426)
MFCD04137106
ZINC000002853208
ZINC02853208
ZINC2853208
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