N-[2-(3-carbamimidoylphenoxy)-5-(methylsulfonylamino)phenyl]-4-(2-sulfamoylphenyl)benzamide

Systemtic Name: N-[2-(3-carbamimidoylphenoxy)-5-(methylsulfonylamino)phenyl]-4-(2-sulfamoylphenyl)benzamide Openeye Name: N-[2-(3-carbamimidoylphenoxy)-5-(methanesulfonamido)phenyl]-4-(2-sulfamoylphenyl)benzamide CAS Name: N-[2-(3-carbamimidoylphenoxy)-5-(methanesulfonamido)phenyl]-4-(2-sulfamoylphenyl)benzamide IUPAC Name: N-[2-(3-carbamimidoylphenoxy)-5-(methanesulfonamido)phenyl]-4-(2-sulfamoylphenyl)benzamide Traditional Name: N-[2-(3-amidinophenoxy)-5-(methanesulfonamido)phenyl]-4-(2-sulfamoylphenyl)benzamide Formula: C27H25N5O6S2 MolecularWeight: 579.6473

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC(=C(C=C1)OC2=CC=CC(=C2)C(=N)N)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

Isomeric SMILES

CS(=O)(=O)NC1=CC(=C(C=C1)OC2=CC=CC(=C2)C(=N)N)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

InChI

InChI=1S/C27H25N5O6S2/c1-39(34,35)32-20-13-14-24(38-21-6-4-5-19(15-21)26(28)29)23(16-20)31-27(33)18-11-9-17(10-12-18)22-7-2-3-8-25(22)40(30,36)37/h2-16,32H,1H3,(H3,28,29)(H,31,33)(H2,30,36,37)