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

Systemtic Name: 2-[(3-carbamimidoylphenyl)methyl-(phenylmethyl)amino]-N-[4-(2-sulfamoylphenyl)phenyl]ethanamide Openeye Name: 2-[benzyl-[(3-carbamimidoylphenyl)methyl]amino]-N-[4-(2-sulfamoylphenyl)phenyl]acetamide CAS Name: 2-[(3-carbamimidoylphenyl)methyl-(phenylmethyl)amino]-N-[4-(2-sulfamoylphenyl)phenyl]acetamide IUPAC Name: 2-[benzyl-[(3-carbamimidoylphenyl)methyl]amino]-N-[4-(2-sulfamoylphenyl)phenyl]acetamide Traditional Name: 2-[(3-amidinobenzyl)-benzyl-amino]-N-[4-(2-sulfamoylphenyl)phenyl]acetamide Formula: C29H29N5O3S MolecularWeight: 527.63726

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C29H29N5O3S/c30-29(31)24-10-6-9-22(17-24)19-34(18-21-7-2-1-3-8-21)20-28(35)33-25-15-13-23(14-16-25)26-11-4-5-12-27(26)38(32,36)37/h1-17H,18-20H2,(H3,30,31)(H,33,35)(H2,32,36,37)