2-(3-carbamimidoylphenoxy)-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-2-phenyl-ethanamide

Systemtic Name: 2-(3-carbamimidoylphenoxy)-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-2-phenyl-ethanamide Openeye Name: 2-(3-carbamimidoylphenoxy)-N-[4-(3-oxopiperazin-1-yl)phenyl]-2-phenyl-acetamide CAS Name: 2-(3-carbamimidoylphenoxy)-N-[4-(3-oxo-1-piperazinyl)phenyl]-2-phenylacetamide IUPAC Name: 2-(3-carbamimidoylphenoxy)-N-[4-(3-oxopiperazin-1-yl)phenyl]-2-phenylacetamide Traditional Name: 2-(3-amidinophenoxy)-N-[4-(3-ketopiperazino)phenyl]-2-phenyl-acetamide Formula: C25H25N5O3 MolecularWeight: 443.4977

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)C(C3=CC=CC=C3)OC4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)C(C3=CC=CC=C3)OC4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C25H25N5O3/c26-24(27)18-7-4-8-21(15-18)33-23(17-5-2-1-3-6-17)25(32)29-19-9-11-20(12-10-19)30-14-13-28-22(31)16-30/h1-12,15,23H,13-14,16H2,(H3,26,27)(H,28,31)(H,29,32)