2-(3-carbamimidoylphenoxy)-4-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]butanamide

Systemtic Name: 2-(3-carbamimidoylphenoxy)-4-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]butanamide Openeye Name: 2-(3-carbamimidoylphenoxy)-4-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]butanamide CAS Name: 2-(3-carbamimidoylphenoxy)-4-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]butanamide IUPAC Name: 2-(3-carbamimidoylphenoxy)-4-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]butanamide Traditional Name: 2-(3-amidinophenoxy)-4-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]butyramide Formula: C29H28N4O4S MolecularWeight: 528.62202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)OC4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)CCC(C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)OC4=CC=CC(=C4)C(=N)N

InChI

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