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

Systemtic Name: 3-(3-carbamimidoylphenyl)-5-(hydroxymethyl)-N-[2-(2-sulfamoylphenyl)phenyl]-1,2-oxazole-4-carboxamide Openeye Name: 3-(3-carbamimidoylphenyl)-5-(hydroxymethyl)-N-[2-(2-sulfamoylphenyl)phenyl]isoxazole-4-carboxamide CAS Name: 3-(3-carbamimidoylphenyl)-5-(hydroxymethyl)-N-[2-(2-sulfamoylphenyl)phenyl]-4-isoxazolecarboxamide IUPAC Name: 3-(3-carbamimidoylphenyl)-5-(hydroxymethyl)-N-[2-(2-sulfamoylphenyl)phenyl]-1,2-oxazole-4-carboxamide Traditional Name: 3-(3-amidinophenyl)-5-methylol-N-[2-(2-sulfamoylphenyl)phenyl]isoxazole-4-carboxamide Formula: C24H21N5O5S MolecularWeight: 491.51904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=CC=C2S(=O)(=O)N)NC(=O)C3=C(ON=C3C4=CC(=CC=C4)C(=N)N)CO

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=CC=C2S(=O)(=O)N)NC(=O)C3=C(ON=C3C4=CC(=CC=C4)C(=N)N)CO

InChI

InChI=1S/C24H21N5O5S/c25-23(26)15-7-5-6-14(12-15)22-21(19(13-30)34-29-22)24(31)28-18-10-3-1-8-16(18)17-9-2-4-11-20(17)35(27,32)33/h1-12,30H,13H2,(H3,25,26)(H,28,31)(H2,27,32,33)