3-[2-[4-(5-carbamimidoylpyrazin-2-yl)phenyl]-1H-imidazol-5-yl]propanoic acid

Systemtic Name: 3-[2-[4-(5-carbamimidoylpyrazin-2-yl)phenyl]-1H-imidazol-5-yl]propanoic acid Openeye Name: 3-[2-[4-(5-carbamimidoylpyrazin-2-yl)phenyl]-1H-imidazol-5-yl]propanoic acid CAS Name: 3-[2-[4-(5-carbamimidoyl-2-pyrazinyl)phenyl]-1H-imidazol-5-yl]propanoic acid IUPAC Name: 3-[2-[4-(5-carbamimidoylpyrazin-2-yl)phenyl]-1H-imidazol-5-yl]propanoic acid Traditional Name: 3-[2-[4-(5-amidinopyrazin-2-yl)phenyl]-1H-imidazol-5-yl]propionic acid Formula: C17H16N6O2 MolecularWeight: 336.34794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CN=C(C=N2)C(=N)N)C3=NC=C(N3)CCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=CN=C(C=N2)C(=N)N)C3=NC=C(N3)CCC(=O)O

InChI

InChI=1S/C17H16N6O2/c18-16(19)14-9-20-13(8-21-14)10-1-3-11(4-2-10)17-22-7-12(23-17)5-6-15(24)25/h1-4,7-9H,5-6H2,(H3,18,19)(H,22,23)(H,24,25)