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

Systemtic Name: 2-[(3-carbamimidoylphenyl)amino]-N-[4-(2-sulfamoylphenyl)phenyl]propanamide Openeye Name: 2-(3-carbamimidoylanilino)-N-[4-(2-sulfamoylphenyl)phenyl]propanamide CAS Name: 2-(3-carbamimidoylanilino)-N-[4-(2-sulfamoylphenyl)phenyl]propanamide IUPAC Name: 2-(3-carbamimidoylanilino)-N-[4-(2-sulfamoylphenyl)phenyl]propanamide Traditional Name: 2-(3-amidinoanilino)-N-[4-(2-sulfamoylphenyl)phenyl]propionamide Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)N)NC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)N)NC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C22H23N5O3S/c1-14(26-18-6-4-5-16(13-18)21(23)24)22(28)27-17-11-9-15(10-12-17)19-7-2-3-8-20(19)31(25,29)30/h2-14,26H,1H3,(H3,23,24)(H,27,28)(H2,25,29,30)