4-[2-azanyl-5-(3-chloranyl-2-fluoranyl-phenyl)pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-[2-azanyl-5-(3-chloranyl-2-fluoranyl-phenyl)pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[2-amino-5-(3-chloro-2-fluoro-phenyl)pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid CAS Name: 4-[2-amino-5-(3-chloro-2-fluorophenyl)-4-pyrimidinyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-[2-amino-5-(3-chloro-2-fluorophenyl)pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Traditional Name: 4-[2-amino-5-(3-chloro-2-fluoro-phenyl)pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Formula: C15H10ClFN4O2 MolecularWeight: 332.716903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)F)C2=CN=C(N=C2C3=CNC(=C3)C(=O)O)N

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)F)C2=CN=C(N=C2C3=CNC(=C3)C(=O)O)N

InChI

InChI=1S/C15H10ClFN4O2/c16-10-3-1-2-8(12(10)17)9-6-20-15(18)21-13(9)7-4-11(14(22)23)19-5-7/h1-6,19H,(H,22,23)(H2,18,20,21)