methyl 2-[3-[4-(4-carbamimidoylphenyl)phenyl]-2-oxidanylidene-1,3-diazinan-1-yl]ethanoate

Systemtic Name: methyl 2-[3-[4-(4-carbamimidoylphenyl)phenyl]-2-oxidanylidene-1,3-diazinan-1-yl]ethanoate Openeye Name: methyl 2-[3-[4-(4-carbamimidoylphenyl)phenyl]-2-oxo-hexahydropyrimidin-1-yl]acetate CAS Name: 2-[3-[4-(4-carbamimidoylphenyl)phenyl]-2-oxo-1,3-diazinan-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[4-(4-carbamimidoylphenyl)phenyl]-2-oxo-1,3-diazinan-1-yl]acetate Traditional Name: 2-[3-[4-(4-amidinophenyl)phenyl]-2-keto-hexahydropyrimidin-1-yl]acetic acid methyl ester Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1CCCN(C1=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CN1CCCN(C1=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H22N4O3/c1-27-18(25)13-23-11-2-12-24(20(23)26)17-9-7-15(8-10-17)14-3-5-16(6-4-14)19(21)22/h3-10H,2,11-13H2,1H3,(H3,21,22)