methyl 3-[5-[4-(5-carbamimidoylpyridin-2-yl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]propanoate

Systemtic Name: methyl 3-[5-[4-(5-carbamimidoylpyridin-2-yl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]propanoate Openeye Name: methyl 3-[5-[4-(5-carbamimidoyl-2-pyridyl)phenyl]-2-oxo-imidazolidin-1-yl]propanoate CAS Name: 3-[5-[4-(5-carbamimidoyl-2-pyridinyl)phenyl]-2-oxo-1-imidazolidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-[4-(5-carbamimidoylpyridin-2-yl)phenyl]-2-oxoimidazolidin-1-yl]propanoate Traditional Name: 3-[5-[4-(5-amidino-2-pyridyl)phenyl]-2-keto-imidazolidin-1-yl]propionic acid methyl ester Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5O3/c1-27-17(25)8-9-24-16(11-23-19(24)26)13-4-2-12(3-5-13)15-7-6-14(10-22-15)18(20)21/h2-7,10,16H,8-9,11H2,1H3,(H3,20,21)(H,23,26)