Vitas-M small molecule compound
1-(1,3-benzodioxol-5-yl)-3-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]urea
Catalog ID
STK495288
SMILES O=C(Nc1ccn(n1)Cc1c(F)cccc1Cl)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 C18H14ClFN4O3 MW 388.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14ClFN4O3/c19-13-2-1-3-14(20)12(13)9-24-7-6-17(23-24)22-18(25)21-11-4-5-15-16(8-11)27-10-26-15/h1-8H,9-10H2,(H2,21,22,23,25)InChIKey
VXBWPUDGUAHETI-UHFFFAOYSA-NSynonyms
1(13benzodioxol5yl)3(1((2chloro6fluorophenyl)methyl)pyrazol3yl)urea
1(13benzodioxol5yl)3(1(2chloro6fluorobenzyl)1Hpyrazol3yl)urea
C1OC2=C(O1)C=C(C=C2)NC(=O)NC3=NN(C=C3)CC4=C(C=CC=C4Cl)F
InChI=1SC18H14ClFN4O3c191321314(20)12(13)9247617(2324)2218(25)2111451516(811)27102615h18H910H2(H221222325)
MFCD04292462
ZINC000020429037
ZINC20429037
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