methyl 3-[4-[4-(4-carbamimidoylphenyl)-3-methoxy-5-oxidanylidene-2H-pyrrol-1-yl]phenyl]-2-(methylsulfonylamino)propanoate

Systemtic Name: methyl 3-[4-[4-(4-carbamimidoylphenyl)-3-methoxy-5-oxidanylidene-2H-pyrrol-1-yl]phenyl]-2-(methylsulfonylamino)propanoate Openeye Name: methyl 3-[4-[4-(4-carbamimidoylphenyl)-3-methoxy-5-oxo-2H-pyrrol-1-yl]phenyl]-2-(methanesulfonamido)propanoate CAS Name: 3-[4-[4-(4-carbamimidoylphenyl)-3-methoxy-5-oxo-2H-pyrrol-1-yl]phenyl]-2-(methanesulfonamido)propanoic acid methyl ester IUPAC Name: methyl 3-[4-[4-(4-carbamimidoylphenyl)-3-methoxy-5-oxo-2H-pyrrol-1-yl]phenyl]-2-(methanesulfonamido)propanoate Traditional Name: 3-[4-[3-(4-amidinophenyl)-2-keto-4-methoxy-3-pyrrolin-1-yl]phenyl]-2-(methanesulfonamido)propionic acid methyl ester Formula: C23H26N4O6S MolecularWeight: 486.54074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)N(C1)C2=CC=C(C=C2)CC(C(=O)OC)NS(=O)(=O)C)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC1=C(C(=O)N(C1)C2=CC=C(C=C2)CC(C(=O)OC)NS(=O)(=O)C)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C23H26N4O6S/c1-32-19-13-27(22(28)20(19)15-6-8-16(9-7-15)21(24)25)17-10-4-14(5-11-17)12-18(23(29)33-2)26-34(3,30)31/h4-11,18,26H,12-13H2,1-3H3,(H3,24,25)