2-[3-[[4-(cyclopropylamino)-5-fluoranyl-pyrimidin-2-yl]amino]phenoxy]-N-methyl-ethanamide

Systemtic Name: 2-[3-[[4-(cyclopropylamino)-5-fluoranyl-pyrimidin-2-yl]amino]phenoxy]-N-methyl-ethanamide Openeye Name: 2-[3-[[4-(cyclopropylamino)-5-fluoro-pyrimidin-2-yl]amino]phenoxy]-N-methyl-acetamide CAS Name: 2-[3-[[4-(cyclopropylamino)-5-fluoro-2-pyrimidinyl]amino]phenoxy]-N-methylacetamide IUPAC Name: 2-[3-[[4-(cyclopropylamino)-5-fluoropyrimidin-2-yl]amino]phenoxy]-N-methylacetamide Traditional Name: 2-[3-[[4-(cyclopropylamino)-5-fluoro-pyrimidin-2-yl]amino]phenoxy]-N-methyl-acetamide Formula: C16H18FN5O2 MolecularWeight: 331.344823

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)COC1=CC=CC(=C1)NC2=NC=C(C(=N2)NC3CC3)F

Isomeric SMILES

CNC(=O)COC1=CC=CC(=C1)NC2=NC=C(C(=N2)NC3CC3)F

InChI

InChI=1S/C16H18FN5O2/c1-18-14(23)9-24-12-4-2-3-11(7-12)21-16-19-8-13(17)15(22-16)20-10-5-6-10/h2-4,7-8,10H,5-6,9H2,1H3,(H,18,23)(H2,19,20,21,22)