3-(3-carbamimidoylphenyl)-N-[4-(2-sulfamoylphenyl)phenyl]-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: 3-(3-carbamimidoylphenyl)-N-[4-(2-sulfamoylphenyl)phenyl]-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: 3-(3-carbamimidoylphenyl)-N-[4-(2-sulfamoylphenyl)phenyl]-4,5-dihydroisoxazole-5-carboxamide CAS Name: 3-(3-carbamimidoylphenyl)-N-[4-(2-sulfamoylphenyl)phenyl]-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: 3-(3-carbamimidoylphenyl)-N-[4-(2-sulfamoylphenyl)phenyl]-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: 3-(3-amidinophenyl)-N-[4-(2-sulfamoylphenyl)phenyl]-2-isoxazoline-5-carboxamide Formula: C23H21N5O4S MolecularWeight: 463.50894

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1C2=CC(=CC=C2)C(=N)N)C(=O)NC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

Isomeric SMILES

C1C(ON=C1C2=CC(=CC=C2)C(=N)N)C(=O)NC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

InChI

InChI=1S/C23H21N5O4S/c24-22(25)16-5-3-4-15(12-16)19-13-20(32-28-19)23(29)27-17-10-8-14(9-11-17)18-6-1-2-7-21(18)33(26,30)31/h1-12,20H,13H2,(H3,24,25)(H,27,29)(H2,26,30,31)