N-(3-carbamimidoylphenyl)-2-[4-(2-methylsulfonylphenyl)phenoxy]-2-phenyl-ethanamide

Systemtic Name: N-(3-carbamimidoylphenyl)-2-[4-(2-methylsulfonylphenyl)phenoxy]-2-phenyl-ethanamide Openeye Name: N-(3-carbamimidoylphenyl)-2-[4-(2-methylsulfonylphenyl)phenoxy]-2-phenyl-acetamide CAS Name: N-(3-carbamimidoylphenyl)-2-[4-(2-methylsulfonylphenyl)phenoxy]-2-phenylacetamide IUPAC Name: N-(3-carbamimidoylphenyl)-2-[4-(2-methylsulfonylphenyl)phenoxy]-2-phenylacetamide Traditional Name: N-(3-amidinophenyl)-2-[4-(2-mesylphenyl)phenoxy]-2-phenyl-acetamide Formula: C28H25N3O4S MolecularWeight: 499.5808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)OC(C3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)OC(C3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C28H25N3O4S/c1-36(33,34)25-13-6-5-12-24(25)19-14-16-23(17-15-19)35-26(20-8-3-2-4-9-20)28(32)31-22-11-7-10-21(18-22)27(29)30/h2-18,26H,1H3,(H3,29,30)(H,31,32)