Vitas-M small molecule compound
methyl N-({5-fluoro-2-[(pyrrolidin-1-ylcarbonyl)amino]phenyl}carbonyl)alaninate
Catalog ID
STL157710
SMILES COC(=O)C(NC(=O)c1cc(F)ccc1NC(=O)N1CCCC1)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 C16H20FN3O4 MW 337.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20FN3O4/c1-10(15(22)24-2)18-14(21)12-9-11(17)5-6-13(12)19-16(23)20-7-3-4-8-20/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,18,21)(H,19,23)InChIKey
WZRRNIOWVHVFGM-UHFFFAOYSA-NSynonyms
(S)methyl2(5fluoro2(pyrrolidine1carboxamido)benzamido)propanoate
CC(C(=O)OC)NC(=O)C1=C(C=CC(=C1)F)NC(=O)N2CCCC2
COC(=O)(C@@H)(NC(=O)c1cc(F)ccc1NC(=O)N1CCCC1)C
InChI=1SC16H20FN3O4c110(15(22)242)1814(21)12911(17)5613(12)1916(23)20734820h56910H3478H212H3(H1821)(H1923)
methyl2((5fluoro2(pyrrolidine1carbonylamino)benzoyl)amino)propanoate
methylN((5fluoro2((pyrrolidin1ylcarbonyl)amino)phenyl)carbonyl)alaninate
MFCD20758093
ZINC000049548369
ZINC000071333231
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