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

Systemtic Name: 2-[(3-carbamimidoylphenyl)amino]-2-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]ethanamide Openeye Name: 2-(3-carbamimidoylanilino)-2-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]acetamide CAS Name: 2-(3-carbamimidoylanilino)-2-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]acetamide IUPAC Name: 2-(3-carbamimidoylanilino)-2-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]acetamide Traditional Name: 2-(3-amidinoanilino)-2-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]acetamide Formula: C27H25N5O3S MolecularWeight: 499.5841

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)NC4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)NC4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C27H25N5O3S/c28-26(29)20-9-6-10-22(17-20)31-25(19-7-2-1-3-8-19)27(33)32-21-15-13-18(14-16-21)23-11-4-5-12-24(23)36(30,34)35/h1-17,25,31H,(H3,28,29)(H,32,33)(H2,30,34,35)