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

Systemtic Name: methyl 2-[4-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]sulfinylethanoate Openeye Name: methyl 2-[4-[3-(4-carbamimidoylphenyl)-2-oxo-imidazolidin-1-yl]phenyl]sulfinylacetate CAS Name: 2-[4-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolidinyl]phenyl]sulfinylacetic acid methyl ester IUPAC Name: methyl 2-[4-[3-(4-carbamimidoylphenyl)-2-oxoimidazolidin-1-yl]phenyl]sulfinylacetate Traditional Name: 2-[4-[3-(4-amidinophenyl)-2-keto-imidazolidin-1-yl]phenyl]sulfinylacetic acid methyl ester Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CS(=O)C1=CC=C(C=C1)N2CCN(C2=O)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CS(=O)C1=CC=C(C=C1)N2CCN(C2=O)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H20N4O4S/c1-27-17(24)12-28(26)16-8-6-15(7-9-16)23-11-10-22(19(23)25)14-4-2-13(3-5-14)18(20)21/h2-9H,10-12H2,1H3,(H3,20,21)