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

Systemtic Name: 2-[(3-carbamimidoylphenyl)amino]-N-[4-(2-sulfamoylphenyl)phenyl]ethanamide Openeye Name: 2-(3-carbamimidoylanilino)-N-[4-(2-sulfamoylphenyl)phenyl]acetamide CAS Name: 2-(3-carbamimidoylanilino)-N-[4-(2-sulfamoylphenyl)phenyl]acetamide IUPAC Name: 2-(3-carbamimidoylanilino)-N-[4-(2-sulfamoylphenyl)phenyl]acetamide Traditional Name: 2-(3-amidinoanilino)-N-[4-(2-sulfamoylphenyl)phenyl]acetamide Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)NC(=O)CNC3=CC=CC(=C3)C(=N)N)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)NC(=O)CNC3=CC=CC(=C3)C(=N)N)S(=O)(=O)N

InChI

InChI=1S/C21H21N5O3S/c22-21(23)15-4-3-5-17(12-15)25-13-20(27)26-16-10-8-14(9-11-16)18-6-1-2-7-19(18)30(24,28)29/h1-12,25H,13H2,(H3,22,23)(H,26,27)(H2,24,28,29)