ethyl (2S)-3,3,3-tris(fluoranyl)-2-[(2-fluorophenyl)carbonylamino]-2-[(4-methylpyridin-2-yl)amino]propanoate

Systemtic Name: ethyl (2S)-3,3,3-tris(fluoranyl)-2-[(2-fluorophenyl)carbonylamino]-2-[(4-methylpyridin-2-yl)amino]propanoate Openeye Name: ethyl (2S)-3,3,3-trifluoro-2-[(2-fluorobenzoyl)amino]-2-[(4-methyl-2-pyridyl)amino]propanoate CAS Name: (2S)-3,3,3-trifluoro-2-[[(2-fluorophenyl)-oxomethyl]amino]-2-[(4-methyl-2-pyridinyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-3,3,3-trifluoro-2-[(2-fluorobenzoyl)amino]-2-[(4-methylpyridin-2-yl)amino]propanoate Traditional Name: (2S)-3,3,3-trifluoro-2-[(2-fluorobenzoyl)amino]-2-[(4-methyl-2-pyridyl)amino]propionic acid ethyl ester Formula: C18H17F4N3O3 MolecularWeight: 399.339493

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(F)(F)F)(NC1=NC=CC(=C1)C)NC(=O)C2=CC=CC=C2F

Isomeric SMILES

CCOC(=O)[C@](C(F)(F)F)(NC1=NC=CC(=C1)C)NC(=O)C2=CC=CC=C2F

InChI

InChI=1S/C18H17F4N3O3/c1-3-28-16(27)17(18(20,21)22,24-14-10-11(2)8-9-23-14)25-15(26)12-6-4-5-7-13(12)19/h4-10H,3H2,1-2H3,(H,23,24)(H,25,26)/t17-/m0/s1