Vitas-M small molecule compound
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(trifluoromethyl)phenyl]thiourea
Catalog ID
STK456546
SMILES S=C(Nc1ccccc1C(F)(F)F)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 C16H13F3N2O2S MW 354.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13F3N2O2S/c17-16(18,19)11-3-1-2-4-12(11)21-15(24)20-10-5-6-13-14(9-10)23-8-7-22-13/h1-6,9H,7-8H2,(H2,20,21,24)InChIKey
NYJJHWPPROYKLM-UHFFFAOYSA-NSynonyms
(2H3HBENZO(34E)14DIOXAN6YLAMINO)((2(TRIFLUOROMETHYL)PHENYL)AMINO)METHANE1THIONE
1(23dihydro14benzodioxin6yl)3(2(trifluoromethyl)phenyl)thiourea
C1COC2=C(O1)C=CC(=C2)NC(=S)NC3=CC=CC=C3C(F)(F)F
InChI=1SC16H13F3N2O2Sc1716(1819)11312412(11)2115(24)2010561314(910)23872213h169H78H2(H2202124)
MFCD04129182
ZINC000001121712
ZINC01121712
ZINC1121712
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