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

Systemtic Name: methyl 3-[5-[4-(5-carbamimidoylpyrimidin-2-yl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]propanoate hydrochloride Openeye Name: methyl 3-[5-[4-(5-carbamimidoylpyrimidin-2-yl)phenyl]-2-oxo-imidazolidin-1-yl]propanoate hydrochloride CAS Name: 3-[5-[4-(5-carbamimidoyl-2-pyrimidinyl)phenyl]-2-oxo-1-imidazolidinyl]propanoic acid methyl ester hydrochloride IUPAC Name: methyl 3-[5-[4-(5-carbamimidoylpyrimidin-2-yl)phenyl]-2-oxoimidazolidin-1-yl]propanoate hydrochloride Traditional Name: 3-[5-[4-(5-amidinopyrimidin-2-yl)phenyl]-2-keto-imidazolidin-1-yl]propionic acid methyl ester hydrochloride Formula: C18H21ClN6O3 MolecularWeight: 404.85074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(CNC1=O)C2=CC=C(C=C2)C3=NC=C(C=N3)C(=N)N.Cl

Isomeric SMILES

COC(=O)CCN1C(CNC1=O)C2=CC=C(C=C2)C3=NC=C(C=N3)C(=N)N.Cl

InChI

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