N-[3-(1H-imidazol-5-yl)propyl]-N-[N'-(2-oxidanyl-3-phenoxy-propyl)carbamimidoyl]benzamide

Systemtic Name: N-[3-(1H-imidazol-5-yl)propyl]-N-[N'-(2-oxidanyl-3-phenoxy-propyl)carbamimidoyl]benzamide Openeye Name: N-[N'-(2-hydroxy-3-phenoxy-propyl)carbamimidoyl]-N-[3-(1H-imidazol-5-yl)propyl]benzamide CAS Name: N-[amino-(2-hydroxy-3-phenoxypropyl)iminomethyl]-N-[3-(1H-imidazol-5-yl)propyl]benzamide IUPAC Name: N-[N'-(2-hydroxy-3-phenoxypropyl)carbamimidoyl]-N-[3-(1H-imidazol-5-yl)propyl]benzamide Traditional Name: N-[N'-(2-hydroxy-3-phenoxy-propyl)amidino]-N-[3-(1H-imidazol-5-yl)propyl]benzamide Formula: C23H27N5O3 MolecularWeight: 421.49218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N(CCCC2=CN=CN2)C(=NCC(COC3=CC=CC=C3)O)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N(CCCC2=CN=CN2)C(=NCC(COC3=CC=CC=C3)O)N

InChI

InChI=1S/C23H27N5O3/c24-23(26-15-20(29)16-31-21-11-5-2-6-12-21)28(13-7-10-19-14-25-17-27-19)22(30)18-8-3-1-4-9-18/h1-6,8-9,11-12,14,17,20,29H,7,10,13,15-16H2,(H2,24,26)(H,25,27)