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

Systemtic Name: 3-[1-[6-(4-carbamimidoyl-2-fluoranyl-phenyl)pyridazin-3-yl]imidazol-4-yl]propanoic acid Openeye Name: 3-[1-[6-(4-carbamimidoyl-2-fluoro-phenyl)pyridazin-3-yl]imidazol-4-yl]propanoic acid CAS Name: 3-[1-[6-(4-carbamimidoyl-2-fluorophenyl)-3-pyridazinyl]-4-imidazolyl]propanoic acid IUPAC Name: 3-[1-[6-(4-carbamimidoyl-2-fluorophenyl)pyridazin-3-yl]imidazol-4-yl]propanoic acid Traditional Name: 3-[1-[6-(4-amidino-2-fluoro-phenyl)pyridazin-3-yl]imidazol-4-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)N3C=C(N=C3)CCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=N)N)F)C2=NN=C(C=C2)N3C=C(N=C3)CCC(=O)O

InChI

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