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

Systemtic Name: 3-(3-carbamimidoylphenyl)-5-(2-methylpropoxymethyl)-N-[4-(2-sulfamoylphenyl)phenyl]-4H-1,2-oxazole-5-carboxamide Openeye Name: 3-(3-carbamimidoylphenyl)-5-(isobutoxymethyl)-N-[4-(2-sulfamoylphenyl)phenyl]-4H-isoxazole-5-carboxamide CAS Name: 3-(3-carbamimidoylphenyl)-5-(2-methylpropoxymethyl)-N-[4-(2-sulfamoylphenyl)phenyl]-4H-isoxazole-5-carboxamide IUPAC Name: 3-(3-carbamimidoylphenyl)-5-(2-methylpropoxymethyl)-N-[4-(2-sulfamoylphenyl)phenyl]-4H-1,2-oxazole-5-carboxamide Traditional Name: 3-(3-amidinophenyl)-5-(isobutoxymethyl)-N-[4-(2-sulfamoylphenyl)phenyl]-2-isoxazoline-5-carboxamide Formula: C28H31N5O5S MolecularWeight: 549.64124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCC1(CC(=NO1)C2=CC(=CC=C2)C(=N)N)C(=O)NC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

Isomeric SMILES

CC(C)COCC1(CC(=NO1)C2=CC(=CC=C2)C(=N)N)C(=O)NC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

InChI

InChI=1S/C28H31N5O5S/c1-18(2)16-37-17-28(15-24(33-38-28)20-6-5-7-21(14-20)26(29)30)27(34)32-22-12-10-19(11-13-22)23-8-3-4-9-25(23)39(31,35)36/h3-14,18H,15-17H2,1-2H3,(H3,29,30)(H,32,34)(H2,31,35,36)