methyl 3-[5-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-2-oxidanylidene-imidazolidin-1-yl]propanoate

Systemtic Name: methyl 3-[5-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-2-oxidanylidene-imidazolidin-1-yl]propanoate Openeye Name: methyl 3-[5-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-2-oxo-imidazolidin-1-yl]propanoate CAS Name: 3-[5-[6-(4-carbamimidoylphenyl)-3-pyridazinyl]-2-oxo-1-imidazolidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-2-oxoimidazolidin-1-yl]propanoate Traditional Name: 3-[5-[6-(4-amidinophenyl)pyridazin-3-yl]-2-keto-imidazolidin-1-yl]propionic acid methyl ester Formula: C18H20N6O3 MolecularWeight: 368.3898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(CNC1=O)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CCN1C(CNC1=O)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C18H20N6O3/c1-27-16(25)8-9-24-15(10-21-18(24)26)14-7-6-13(22-23-14)11-2-4-12(5-3-11)17(19)20/h2-7,15H,8-10H2,1H3,(H3,19,20)(H,21,26)