methyl 3-[2-[4-(5-carbamimidoylpyrazin-2-yl)phenyl]-1H-imidazol-5-yl]propanoate

Systemtic Name: methyl 3-[2-[4-(5-carbamimidoylpyrazin-2-yl)phenyl]-1H-imidazol-5-yl]propanoate Openeye Name: methyl 3-[2-[4-(5-carbamimidoylpyrazin-2-yl)phenyl]-1H-imidazol-5-yl]propanoate CAS Name: 3-[2-[4-(5-carbamimidoyl-2-pyrazinyl)phenyl]-1H-imidazol-5-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[4-(5-carbamimidoylpyrazin-2-yl)phenyl]-1H-imidazol-5-yl]propanoate Traditional Name: 3-[2-[4-(5-amidinopyrazin-2-yl)phenyl]-1H-imidazol-5-yl]propionic acid methyl ester Formula: C18H18N6O2 MolecularWeight: 350.37452

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CN=C(N1)C2=CC=C(C=C2)C3=CN=C(C=N3)C(=N)N

Isomeric SMILES

COC(=O)CCC1=CN=C(N1)C2=CC=C(C=C2)C3=CN=C(C=N3)C(=N)N

InChI

InChI=1S/C18H18N6O2/c1-26-16(25)7-6-13-8-23-18(24-13)12-4-2-11(3-5-12)14-9-22-15(10-21-14)17(19)20/h2-5,8-10H,6-7H2,1H3,(H3,19,20)(H,23,24)