N-[2-[2-(tert-butylsulfamoyl)phenyl]phenyl]-3-(3-carbamimidoylphenyl)-1,2-oxazole-4-carboxamide

Systemtic Name: N-[2-[2-(tert-butylsulfamoyl)phenyl]phenyl]-3-(3-carbamimidoylphenyl)-1,2-oxazole-4-carboxamide Openeye Name: N-[2-[2-(tert-butylsulfamoyl)phenyl]phenyl]-3-(3-carbamimidoylphenyl)isoxazole-4-carboxamide CAS Name: N-[2-[2-(tert-butylsulfamoyl)phenyl]phenyl]-3-(3-carbamimidoylphenyl)-4-isoxazolecarboxamide IUPAC Name: N-[2-[2-(tert-butylsulfamoyl)phenyl]phenyl]-3-(3-carbamimidoylphenyl)-1,2-oxazole-4-carboxamide Traditional Name: 3-(3-amidinophenyl)-N-[2-[2-(tert-butylsulfamoyl)phenyl]phenyl]isoxazole-4-carboxamide Formula: C27H27N5O4S MolecularWeight: 517.59938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC=CC=C1C2=CC=CC=C2NC(=O)C3=CON=C3C4=CC(=CC=C4)C(=N)N

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC=CC=C1C2=CC=CC=C2NC(=O)C3=CON=C3C4=CC(=CC=C4)C(=N)N

InChI

InChI=1S/C27H27N5O4S/c1-27(2,3)32-37(34,35)23-14-7-5-12-20(23)19-11-4-6-13-22(19)30-26(33)21-16-36-31-24(21)17-9-8-10-18(15-17)25(28)29/h4-16,32H,1-3H3,(H3,28,29)(H,30,33)