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

Systemtic Name: methyl 3-[4-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-2-propan-2-yl-1H-imidazol-5-yl]propanoate Openeye Name: methyl 3-[4-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-2-isopropyl-1H-imidazol-5-yl]propanoate CAS Name: 3-[4-[6-(4-carbamimidoylphenyl)-3-pyridazinyl]-2-propan-2-yl-1H-imidazol-5-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-2-propan-2-yl-1H-imidazol-5-yl]propanoate Traditional Name: 3-[4-[6-(4-amidinophenyl)pyridazin-3-yl]-2-isopropyl-1H-imidazol-5-yl]propionic acid methyl ester Formula: C21H24N6O2 MolecularWeight: 392.45426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=C(N1)CCC(=O)OC)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C)C1=NC(=C(N1)CCC(=O)OC)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H24N6O2/c1-12(2)21-24-16(10-11-18(28)29-3)19(25-21)17-9-8-15(26-27-17)13-4-6-14(7-5-13)20(22)23/h4-9,12H,10-11H2,1-3H3,(H3,22,23)(H,24,25)