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

Systemtic Name: 2-[(3-carbamimidoylphenyl)-methyl-amino]-N-[4-(2-sulfamoylphenyl)phenyl]ethanamide Openeye Name: 2-(3-carbamimidoyl-N-methyl-anilino)-N-[4-(2-sulfamoylphenyl)phenyl]acetamide CAS Name: 2-(3-carbamimidoyl-N-methylanilino)-N-[4-(2-sulfamoylphenyl)phenyl]acetamide IUPAC Name: 2-(3-carbamimidoyl-N-methylanilino)-N-[4-(2-sulfamoylphenyl)phenyl]acetamide Traditional Name: 2-(3-amidino-N-methyl-anilino)-N-[4-(2-sulfamoylphenyl)phenyl]acetamide Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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