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

Systemtic Name: N-[N'-[2-(1H-imidazol-5-yl)ethyl]carbamimidoyl]-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]benzamide Openeye Name: N-[N'-[2-(1H-imidazol-5-yl)ethyl]carbamimidoyl]-N-[3-[3-(1-piperidylmethyl)phenoxy]propyl]benzamide CAS Name: N-[amino-[2-(1H-imidazol-5-yl)ethylimino]methyl]-N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]benzamide IUPAC Name: N-[N'-[2-(1H-imidazol-5-yl)ethyl]carbamimidoyl]-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]benzamide Traditional Name: N-[N'-[2-(1H-imidazol-5-yl)ethyl]amidino]-N-[3-[3-(piperidinomethyl)phenoxy]propyl]benzamide Formula: C28H36N6O2 MolecularWeight: 488.62444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC=C2)OCCCN(C(=O)C3=CC=CC=C3)C(=NCCC4=CN=CN4)N

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC=C2)OCCCN(C(=O)C3=CC=CC=C3)C(=NCCC4=CN=CN4)N

InChI

InChI=1S/C28H36N6O2/c29-28(31-14-13-25-20-30-22-32-25)34(27(35)24-10-3-1-4-11-24)17-8-18-36-26-12-7-9-23(19-26)21-33-15-5-2-6-16-33/h1,3-4,7,9-12,19-20,22H,2,5-6,8,13-18,21H2,(H2,29,31)(H,30,32)