3-(3-carbamimidoylphenyl)-5-(hydroxymethyl)-N-(4-phenylphenyl)-4H-1,2-oxazole-5-carboxamide

Systemtic Name: 3-(3-carbamimidoylphenyl)-5-(hydroxymethyl)-N-(4-phenylphenyl)-4H-1,2-oxazole-5-carboxamide Openeye Name: 3-(3-carbamimidoylphenyl)-5-(hydroxymethyl)-N-(4-phenylphenyl)-4H-isoxazole-5-carboxamide CAS Name: 3-(3-carbamimidoylphenyl)-5-(hydroxymethyl)-N-(4-phenylphenyl)-4H-isoxazole-5-carboxamide IUPAC Name: 3-(3-carbamimidoylphenyl)-5-(hydroxymethyl)-N-(4-phenylphenyl)-4H-1,2-oxazole-5-carboxamide Traditional Name: 3-(3-amidinophenyl)-5-methylol-N-(4-phenylphenyl)-2-isoxazoline-5-carboxamide Formula: C24H22N4O3 MolecularWeight: 414.45648

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NOC1(CO)C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3)C4=CC(=CC=C4)C(=N)N

Isomeric SMILES

C1C(=NOC1(CO)C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3)C4=CC(=CC=C4)C(=N)N

InChI

InChI=1S/C24H22N4O3/c25-22(26)19-8-4-7-18(13-19)21-14-24(15-29,31-28-21)23(30)27-20-11-9-17(10-12-20)16-5-2-1-3-6-16/h1-13,29H,14-15H2,(H3,25,26)(H,27,30)