Vitas-M small molecule compound
methyl 2-(acetylamino)-N-(3,4-dimethoxybenzyl)-3,3,3-trifluoro-N-(tetrahydrofuran-2-ylmethyl)alaninate
Catalog ID
STK691049
SMILES COC(=O)C(C(F)(F)F)(N(Cc1ccc(c(c1)OC)OC)CC1CCCO1)NC(=O)C
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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 C20H27F3N2O6 MW 448.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27F3N2O6/c1-13(26)24-19(18(27)30-4,20(21,22)23)25(12-15-6-5-9-31-15)11-14-7-8-16(28-2)17(10-14)29-3/h7-8,10,15H,5-6,9,11-12H2,1-4H3,(H,24,26)InChIKey
LGBCFKQRFMNWSL-UHFFFAOYSA-NSynonyms
CC(=O)NC(C(=O)OC)(C(F)(F)F)N(CC1CCCO1)CC2=CC(=C(C=C2)OC)OC
InChI=1SC20H27F3N2O6c113(26)2419(18(27)30420(2122)23)25(12156593115)11147816(282)17(1014)293h781015H5691112H214H3(H2426)
methyl2(acetylamino)N(34dimethoxybenzyl)333trifluoroN(tetrahydrofuran2ylmethyl)alaninate
METHYL2ACETAMIDO2((34DIMETHOXYPHENYL)METHYL(OXOLAN2YLMETHYL)AMINO)333TRIFLUOROPROPANOATE
MFCD03617228
PROPANOICACID2(ACETYLAMINO)2(((34DIMETHOXYPHENYL)METHYL)((TETRAHYDRO2FURANYL)METHYL)AMINO)333TRIFLUOROMETHYLESTER
ZINC000012364196
ZINC000245227635
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