methyl 2-[2-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]sulfonylethanoate

Systemtic Name: methyl 2-[2-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]sulfonylethanoate Openeye Name: methyl 2-[2-[3-(4-carbamimidoylphenyl)-2-oxo-imidazolidin-1-yl]phenyl]sulfonylacetate CAS Name: 2-[2-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolidinyl]phenyl]sulfonylacetic acid methyl ester IUPAC Name: methyl 2-[2-[3-(4-carbamimidoylphenyl)-2-oxoimidazolidin-1-yl]phenyl]sulfonylacetate Traditional Name: 2-[2-[3-(4-amidinophenyl)-2-keto-imidazolidin-1-yl]phenyl]sulfonylacetic acid methyl ester Formula: C19H20N4O5S MolecularWeight: 416.4509

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CS(=O)(=O)C1=CC=CC=C1N2CCN(C2=O)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CS(=O)(=O)C1=CC=CC=C1N2CCN(C2=O)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H20N4O5S/c1-28-17(24)12-29(26,27)16-5-3-2-4-15(16)23-11-10-22(19(23)25)14-8-6-13(7-9-14)18(20)21/h2-9H,10-12H2,1H3,(H3,20,21)