2-[(3-carbamimidoylphenyl)methyl-phenyl-amino]-N-[4-(2-sulfamoylphenyl)phenyl]ethanamide

Systemtic Name: 2-[(3-carbamimidoylphenyl)methyl-phenyl-amino]-N-[4-(2-sulfamoylphenyl)phenyl]ethanamide Openeye Name: 2-[N-[(3-carbamimidoylphenyl)methyl]anilino]-N-[4-(2-sulfamoylphenyl)phenyl]acetamide CAS Name: 2-[N-[(3-carbamimidoylphenyl)methyl]anilino]-N-[4-(2-sulfamoylphenyl)phenyl]acetamide IUPAC Name: 2-[N-[(3-carbamimidoylphenyl)methyl]anilino]-N-[4-(2-sulfamoylphenyl)phenyl]acetamide Traditional Name: 2-(N-(3-amidinobenzyl)anilino)-N-[4-(2-sulfamoylphenyl)phenyl]acetamide Formula: C28H27N5O3S MolecularWeight: 513.61068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CC2=CC=CC(=C2)C(=N)N)CC(=O)NC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)N(CC2=CC=CC(=C2)C(=N)N)CC(=O)NC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

InChI

InChI=1S/C28H27N5O3S/c29-28(30)22-8-6-7-20(17-22)18-33(24-9-2-1-3-10-24)19-27(34)32-23-15-13-21(14-16-23)25-11-4-5-12-26(25)37(31,35)36/h1-17H,18-19H2,(H3,29,30)(H,32,34)(H2,31,35,36)