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

Systemtic Name: N-[N'-[3-(1H-imidazol-5-yl)propyl]carbamimidoyl]-N-(3-phenyl-3-pyridin-2-yl-propyl)benzamide Openeye Name: N-[N'-[3-(1H-imidazol-5-yl)propyl]carbamimidoyl]-N-[3-phenyl-3-(2-pyridyl)propyl]benzamide CAS Name: N-[amino-[3-(1H-imidazol-5-yl)propylimino]methyl]-N-[3-phenyl-3-(2-pyridinyl)propyl]benzamide IUPAC Name: N-[N'-[3-(1H-imidazol-5-yl)propyl]carbamimidoyl]-N-(3-phenyl-3-pyridin-2-ylpropyl)benzamide Traditional Name: N-[N'-[3-(1H-imidazol-5-yl)propyl]amidino]-N-[3-phenyl-3-(2-pyridyl)propyl]benzamide Formula: C28H30N6O MolecularWeight: 466.5774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCN(C(=O)C2=CC=CC=C2)C(=NCCCC3=CN=CN3)N)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)C(CCN(C(=O)C2=CC=CC=C2)C(=NCCCC3=CN=CN3)N)C4=CC=CC=N4

InChI

InChI=1S/C28H30N6O/c29-28(32-18-9-14-24-20-30-21-33-24)34(27(35)23-12-5-2-6-13-23)19-16-25(22-10-3-1-4-11-22)26-15-7-8-17-31-26/h1-8,10-13,15,17,20-21,25H,9,14,16,18-19H2,(H2,29,32)(H,30,33)