3-[[5-[(4-fluorophenyl)carbamoyl]pyrimidin-2-yl]amino]propanoic acid

Systemtic Name: 3-[[5-[(4-fluorophenyl)carbamoyl]pyrimidin-2-yl]amino]propanoic acid Openeye Name: 3-[[5-[(4-fluorophenyl)carbamoyl]pyrimidin-2-yl]amino]propanoic acid CAS Name: 3-[[5-[(4-fluoroanilino)-oxomethyl]-2-pyrimidinyl]amino]propanoic acid IUPAC Name: 3-[[5-[(4-fluorophenyl)carbamoyl]pyrimidin-2-yl]amino]propanoic acid Traditional Name: 3-[[5-[(4-fluorophenyl)carbamoyl]pyrimidin-2-yl]amino]propionic acid Formula: C14H13FN4O3 MolecularWeight: 304.276423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=CN=C(N=C2)NCCC(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=CN=C(N=C2)NCCC(=O)O)F

InChI

InChI=1S/C14H13FN4O3/c15-10-1-3-11(4-2-10)19-13(22)9-7-17-14(18-8-9)16-6-5-12(20)21/h1-4,7-8H,5-6H2,(H,19,22)(H,20,21)(H,16,17,18)