3-[2-[6-(4-carbamimidoyl-2-fluoranyl-phenyl)pyridazin-3-yl]-1H-imidazol-5-yl]propanoic acid

Systemtic Name: 3-[2-[6-(4-carbamimidoyl-2-fluoranyl-phenyl)pyridazin-3-yl]-1H-imidazol-5-yl]propanoic acid Openeye Name: 3-[2-[6-(4-carbamimidoyl-2-fluoro-phenyl)pyridazin-3-yl]-1H-imidazol-5-yl]propanoic acid CAS Name: 3-[2-[6-(4-carbamimidoyl-2-fluorophenyl)-3-pyridazinyl]-1H-imidazol-5-yl]propanoic acid IUPAC Name: 3-[2-[6-(4-carbamimidoyl-2-fluorophenyl)pyridazin-3-yl]-1H-imidazol-5-yl]propanoic acid Traditional Name: 3-[2-[6-(4-amidino-2-fluoro-phenyl)pyridazin-3-yl]-1H-imidazol-5-yl]propionic acid Formula: C17H15FN6O2 MolecularWeight: 354.338403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=N)N)F)C2=NN=C(C=C2)C3=NC=C(N3)CCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=N)N)F)C2=NN=C(C=C2)C3=NC=C(N3)CCC(=O)O

InChI

InChI=1S/C17H15FN6O2/c18-12-7-9(16(19)20)1-3-11(12)13-4-5-14(24-23-13)17-21-8-10(22-17)2-6-15(25)26/h1,3-5,7-8H,2,6H2,(H3,19,20)(H,21,22)(H,25,26)