(Z)-3-(3-carbamimidoylphenyl)-2-fluoranyl-4-oxidanyl-N-[4-(2-sulfamoylphenyl)phenyl]but-2-enamide

Systemtic Name: (Z)-3-(3-carbamimidoylphenyl)-2-fluoranyl-4-oxidanyl-N-[4-(2-sulfamoylphenyl)phenyl]but-2-enamide Openeye Name: (Z)-3-(3-carbamimidoylphenyl)-2-fluoro-4-hydroxy-N-[4-(2-sulfamoylphenyl)phenyl]but-2-enamide CAS Name: (Z)-3-(3-carbamimidoylphenyl)-2-fluoro-4-hydroxy-N-[4-(2-sulfamoylphenyl)phenyl]-2-butenamide IUPAC Name: (Z)-3-(3-carbamimidoylphenyl)-2-fluoro-4-hydroxy-N-[4-(2-sulfamoylphenyl)phenyl]but-2-enamide Traditional Name: (Z)-3-(3-amidinophenyl)-2-fluoro-4-hydroxy-N-[4-(2-sulfamoylphenyl)phenyl]but-2-enamide Formula: C23H21FN4O4S MolecularWeight: 468.500643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)NC(=O)C(=C(CO)C3=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)/C(=C(/CO)\C3=CC(=CC=C3)C(=N)N)/F)S(=O)(=O)N

InChI

InChI=1S/C23H21FN4O4S/c24-21(19(13-29)15-4-3-5-16(12-15)22(25)26)23(30)28-17-10-8-14(9-11-17)18-6-1-2-7-20(18)33(27,31)32/h1-12,29H,13H2,(H3,25,26)(H,28,30)(H2,27,31,32)/b21-19+