2-[[4-(4-fluoranylnaphthalen-1-yl)-6-propan-2-yl-pyrimidin-2-yl]amino]propanoic acid

Systemtic Name: 2-[[4-(4-fluoranylnaphthalen-1-yl)-6-propan-2-yl-pyrimidin-2-yl]amino]propanoic acid Openeye Name: 2-[[4-(4-fluoro-1-naphthyl)-6-isopropyl-pyrimidin-2-yl]amino]propanoic acid CAS Name: 2-[[4-(4-fluoro-1-naphthalenyl)-6-propan-2-yl-2-pyrimidinyl]amino]propanoic acid IUPAC Name: 2-[[4-(4-fluoronaphthalen-1-yl)-6-propan-2-ylpyrimidin-2-yl]amino]propanoic acid Traditional Name: 2-[[4-(4-fluoro-1-naphthyl)-6-isopropyl-pyrimidin-2-yl]amino]propionic acid Formula: C20H20FN3O2 MolecularWeight: 353.390103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC(=C1)C2=CC=C(C3=CC=CC=C32)F)NC(C)C(=O)O

Isomeric SMILES

CC(C)C1=NC(=NC(=C1)C2=CC=C(C3=CC=CC=C32)F)NC(C)C(=O)O

InChI

InChI=1S/C20H20FN3O2/c1-11(2)17-10-18(24-20(23-17)22-12(3)19(25)26)15-8-9-16(21)14-7-5-4-6-13(14)15/h4-12H,1-3H3,(H,25,26)(H,22,23,24)