3-(3-carbamimidoylphenyl)-N-[2-fluoranyl-4-(2-sulfamoylphenyl)phenyl]propanamide

Systemtic Name: 3-(3-carbamimidoylphenyl)-N-[2-fluoranyl-4-(2-sulfamoylphenyl)phenyl]propanamide Openeye Name: 3-(3-carbamimidoylphenyl)-N-[2-fluoro-4-(2-sulfamoylphenyl)phenyl]propanamide CAS Name: 3-(3-carbamimidoylphenyl)-N-[2-fluoro-4-(2-sulfamoylphenyl)phenyl]propanamide IUPAC Name: 3-(3-carbamimidoylphenyl)-N-[2-fluoro-4-(2-sulfamoylphenyl)phenyl]propanamide Traditional Name: 3-(3-amidinophenyl)-N-[2-fluoro-4-(2-sulfamoylphenyl)phenyl]propionamide Formula: C22H21FN4O3S MolecularWeight: 440.490543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC(=C(C=C2)NC(=O)CCC3=CC=CC(=C3)C(=N)N)F)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC(=C(C=C2)NC(=O)CCC3=CC=CC(=C3)C(=N)N)F)S(=O)(=O)N

InChI

InChI=1S/C22H21FN4O3S/c23-18-13-15(17-6-1-2-7-20(17)31(26,29)30)9-10-19(18)27-21(28)11-8-14-4-3-5-16(12-14)22(24)25/h1-7,9-10,12-13H,8,11H2,(H3,24,25)(H,27,28)(H2,26,29,30)