Vitas-M small molecule compound
N-1,3-benzodioxol-5-yl-N~2~-(2-fluorobenzyl)-N~2~-(phenylacetyl)isovalinamide
Catalog ID
STL437578
SMILES CCC(N(C(=O)Cc1ccccc1)Cc1ccccc1F)(C(=O)Nc1ccc2c(c1)OCO2)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 C27H27FN2O4 MW 462.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27FN2O4/c1-3-27(2,26(32)29-21-13-14-23-24(16-21)34-18-33-23)30(17-20-11-7-8-12-22(20)28)25(31)15-19-9-5-4-6-10-19/h4-14,16H,3,15,17-18H2,1-2H3,(H,29,32)InChIKey
NGJUWQFTGOZMJB-UHFFFAOYSA-NSynonyms
CCC(C)(C(=O)NC1=CC2=C(C=C1)OCO2)N(CC3=CC=CC=C3F)C(=O)CC4=CC=CC=C4
InChI=1SC27H27FN2O4c1327(226(32)292113142324(1621)34183323)30(172011781222(20)28)25(31)151995461019h41416H3151718H212H3(H2932)
MFCD09957696
N(13BENZODIOXOL5YL)2((2FLUOROBENZYL)(2PHENYLACETYL)AMINO)2METHYLBUTANAMIDE
N(13BENZODIOXOL5YL)2((2FLUOROPHENYL)METHYL(2PHENYLACETYL)AMINO)2METHYLBUTANAMIDE
N13benzodioxol5ylN~2~(2fluorobenzyl)N~2~(phenylacetyl)isovalinamide
ZINC000001416766
ZINC000001416767
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