2-azanyl-3-[2-[5-(4-carbamimidoylphenyl)pyrazin-2-yl]-1H-imidazol-5-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-[5-(4-carbamimidoylphenyl)pyrazin-2-yl]-1H-imidazol-5-yl]propanoic acid Openeye Name: 2-amino-3-[2-[5-(4-carbamimidoylphenyl)pyrazin-2-yl]-1H-imidazol-5-yl]propanoic acid CAS Name: 2-amino-3-[2-[5-(4-carbamimidoylphenyl)-2-pyrazinyl]-1H-imidazol-5-yl]propanoic acid IUPAC Name: 2-amino-3-[2-[5-(4-carbamimidoylphenyl)pyrazin-2-yl]-1H-imidazol-5-yl]propanoic acid Traditional Name: 3-[2-[5-(4-amidinophenyl)pyrazin-2-yl]-1H-imidazol-5-yl]-2-amino-propionic acid Formula: C17H17N7O2 MolecularWeight: 351.36258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N7O2/c18-12(17(25)26)5-11-6-23-16(24-11)14-8-21-13(7-22-14)9-1-3-10(4-2-9)15(19)20/h1-4,6-8,12H,5,18H2,(H3,19,20)(H,23,24)(H,25,26)