Vitas-M small molecule compound
1-(1,3-benzodioxol-5-ylmethyl)-3-[1,1,1-trifluoro-2-(trifluoromethyl)butan-2-yl]urea
Catalog ID
STK375902
SMILES CCC(C(F)(F)F)(C(F)(F)F)NC(=O)NCc1ccc2c(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 C14H14F6N2O3 MW 372.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14F6N2O3/c1-2-12(13(15,16)17,14(18,19)20)22-11(23)21-6-8-3-4-9-10(5-8)25-7-24-9/h3-5H,2,6-7H2,1H3,(H2,21,22,23)InChIKey
LGKPSRDAHGKHFP-UHFFFAOYSA-NSynonyms
((2HBENZO(34D)13DIOXOLAN5YLMETHYL)AMINO)N(11BIS(TRIFLUOROMETHYL)PROPYL)CARBOXAMIDE
1(13benzodioxol5ylmethyl)3(111trifluoro2(trifluoromethyl)butan2yl)urea
1(benzo(d)(13)dioxol5ylmethyl)3(111trifluoro2(trifluoromethyl)butan2yl)urea
CCC(C(F)(F)F)(C(F)(F)F)NC(=O)NCC1=CC2=C(C=C1)OCO2
InChI=1SC14H14F6N2O3c1212(13(1516)1714(1819)20)2211(23)216834910(58)257249h35H267H21H3(H2212223)
MFCD01347809
N(13BENZODIOXOL5YLMETHYL)N(11BIS(TRIFLUOROMETHYL)PROPYL)UREA
ZINC000001050860
ZINC01050860
ZINC1050860
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