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

Systemtic Name: N-[N'-[3-(1H-imidazol-5-yl)propyl]carbamimidoyl]-3-phenyl-3-pyridin-2-yl-propanamide Openeye Name: N-[N'-[3-(1H-imidazol-5-yl)propyl]carbamimidoyl]-3-phenyl-3-(2-pyridyl)propanamide CAS Name: N-[amino-[3-(1H-imidazol-5-yl)propylimino]methyl]-3-phenyl-3-(2-pyridinyl)propanamide IUPAC Name: N-[N'-[3-(1H-imidazol-5-yl)propyl]carbamimidoyl]-3-phenyl-3-pyridin-2-ylpropanamide Traditional Name: N-[N'-[3-(1H-imidazol-5-yl)propyl]amidino]-3-phenyl-3-(2-pyridyl)propionamide Formula: C21H24N6O MolecularWeight: 376.45486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)NC(=NCCCC2=CN=CN2)N)C3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)NC(=NCCCC2=CN=CN2)N)C3=CC=CC=N3

InChI

InChI=1S/C21H24N6O/c22-21(25-12-6-9-17-14-23-15-26-17)27-20(28)13-18(16-7-2-1-3-8-16)19-10-4-5-11-24-19/h1-5,7-8,10-11,14-15,18H,6,9,12-13H2,(H,23,26)(H3,22,25,27,28)