5-(2-azanyl-2-oxidanylidene-ethyl)-3-(3-carbamimidoylphenyl)-N-(4-phenylphenyl)-4H-1,2-oxazole-5-carboxamide

Systemtic Name: 5-(2-azanyl-2-oxidanylidene-ethyl)-3-(3-carbamimidoylphenyl)-N-(4-phenylphenyl)-4H-1,2-oxazole-5-carboxamide Openeye Name: 5-(2-amino-2-oxo-ethyl)-3-(3-carbamimidoylphenyl)-N-(4-phenylphenyl)-4H-isoxazole-5-carboxamide CAS Name: 5-(2-amino-2-oxoethyl)-3-(3-carbamimidoylphenyl)-N-(4-phenylphenyl)-4H-isoxazole-5-carboxamide IUPAC Name: 5-(2-amino-2-oxoethyl)-3-(3-carbamimidoylphenyl)-N-(4-phenylphenyl)-4H-1,2-oxazole-5-carboxamide Traditional Name: 3-(3-amidinophenyl)-5-(2-amino-2-keto-ethyl)-N-(4-phenylphenyl)-2-isoxazoline-5-carboxamide Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23N5O3/c26-22(31)15-25(14-21(30-33-25)18-7-4-8-19(13-18)23(27)28)24(32)29-20-11-9-17(10-12-20)16-5-2-1-3-6-16/h1-13H,14-15H2,(H2,26,31)(H3,27,28)(H,29,32)