N-[2-(3-carbamimidoylphenoxy)ethyl]-N-(phenylmethyl)-4-(2-sulfamoylphenyl)benzamide

Systemtic Name: N-[2-(3-carbamimidoylphenoxy)ethyl]-N-(phenylmethyl)-4-(2-sulfamoylphenyl)benzamide Openeye Name: N-benzyl-N-[2-(3-carbamimidoylphenoxy)ethyl]-4-(2-sulfamoylphenyl)benzamide CAS Name: N-[2-(3-carbamimidoylphenoxy)ethyl]-N-(phenylmethyl)-4-(2-sulfamoylphenyl)benzamide IUPAC Name: N-benzyl-N-[2-(3-carbamimidoylphenoxy)ethyl]-4-(2-sulfamoylphenyl)benzamide Traditional Name: N-[2-(3-amidinophenoxy)ethyl]-N-benzyl-4-(2-sulfamoylphenyl)benzamide Formula: C29H28N4O4S MolecularWeight: 528.62202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCOC2=CC=CC(=C2)C(=N)N)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN(CCOC2=CC=CC(=C2)C(=N)N)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

InChI

InChI=1S/C29H28N4O4S/c30-28(31)24-9-6-10-25(19-24)37-18-17-33(20-21-7-2-1-3-8-21)29(34)23-15-13-22(14-16-23)26-11-4-5-12-27(26)38(32,35)36/h1-16,19H,17-18,20H2,(H3,30,31)(H2,32,35,36)