methyl 3-[2-[6-(4-carbamimidoyl-2-methyl-phenyl)pyridazin-3-yl]-1H-imidazol-5-yl]propanoate

Systemtic Name: methyl 3-[2-[6-(4-carbamimidoyl-2-methyl-phenyl)pyridazin-3-yl]-1H-imidazol-5-yl]propanoate Openeye Name: methyl 3-[2-[6-(4-carbamimidoyl-2-methyl-phenyl)pyridazin-3-yl]-1H-imidazol-5-yl]propanoate CAS Name: 3-[2-[6-(4-carbamimidoyl-2-methylphenyl)-3-pyridazinyl]-1H-imidazol-5-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[6-(4-carbamimidoyl-2-methylphenyl)pyridazin-3-yl]-1H-imidazol-5-yl]propanoate Traditional Name: 3-[2-[6-(4-amidino-2-methyl-phenyl)pyridazin-3-yl]-1H-imidazol-5-yl]propionic acid methyl ester Formula: C19H20N6O2 MolecularWeight: 364.4011

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=N)N)C2=NN=C(C=C2)C3=NC=C(N3)CCC(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C(=N)N)C2=NN=C(C=C2)C3=NC=C(N3)CCC(=O)OC

InChI

InChI=1S/C19H20N6O2/c1-11-9-12(18(20)21)3-5-14(11)15-6-7-16(25-24-15)19-22-10-13(23-19)4-8-17(26)27-2/h3,5-7,9-10H,4,8H2,1-2H3,(H3,20,21)(H,22,23)