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

Systemtic Name: 3-(3-carbamimidoylphenyl)-5-(2-hydroxyethyl)-N-[2-methyl-4-(2-sulfamoylphenyl)phenyl]-4H-1,2-oxazole-5-carboxamide Openeye Name: 3-(3-carbamimidoylphenyl)-5-(2-hydroxyethyl)-N-[2-methyl-4-(2-sulfamoylphenyl)phenyl]-4H-isoxazole-5-carboxamide CAS Name: 3-(3-carbamimidoylphenyl)-5-(2-hydroxyethyl)-N-[2-methyl-4-(2-sulfamoylphenyl)phenyl]-4H-isoxazole-5-carboxamide IUPAC Name: 3-(3-carbamimidoylphenyl)-5-(2-hydroxyethyl)-N-[2-methyl-4-(2-sulfamoylphenyl)phenyl]-4H-1,2-oxazole-5-carboxamide Traditional Name: 3-(3-amidinophenyl)-5-(2-hydroxyethyl)-N-[2-methyl-4-(2-sulfamoylphenyl)phenyl]-2-isoxazoline-5-carboxamide Formula: C26H27N5O5S MolecularWeight: 521.58808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC=CC=C2S(=O)(=O)N)NC(=O)C3(CC(=NO3)C4=CC(=CC=C4)C(=N)N)CCO

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC=CC=C2S(=O)(=O)N)NC(=O)C3(CC(=NO3)C4=CC(=CC=C4)C(=N)N)CCO

InChI

InChI=1S/C26H27N5O5S/c1-16-13-17(20-7-2-3-8-23(20)37(29,34)35)9-10-21(16)30-25(33)26(11-12-32)15-22(31-36-26)18-5-4-6-19(14-18)24(27)28/h2-10,13-14,32H,11-12,15H2,1H3,(H3,27,28)(H,30,33)(H2,29,34,35)