2-[3-(1H-imidazol-5-yl)propyl]-1-[3-(3-nitrophenyl)-3-pyridin-2-yl-propyl]guanidine

Systemtic Name: 2-[3-(1H-imidazol-5-yl)propyl]-1-[3-(3-nitrophenyl)-3-pyridin-2-yl-propyl]guanidine Openeye Name: 2-[3-(1H-imidazol-5-yl)propyl]-1-[3-(3-nitrophenyl)-3-(2-pyridyl)propyl]guanidine CAS Name: 2-[3-(1H-imidazol-5-yl)propyl]-1-[3-(3-nitrophenyl)-3-(2-pyridinyl)propyl]guanidine IUPAC Name: 2-[3-(1H-imidazol-5-yl)propyl]-1-[3-(3-nitrophenyl)-3-pyridin-2-ylpropyl]guanidine Traditional Name: 2-[3-(1H-imidazol-5-yl)propyl]-1-[3-(3-nitrophenyl)-3-(2-pyridyl)propyl]guanidine Formula: C21H25N7O2 MolecularWeight: 407.4689

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(CCNC(=NCCCC2=CN=CN2)N)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)C(CCNC(=NCCCC2=CN=CN2)N)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N7O2/c22-21(25-11-4-6-17-14-23-15-27-17)26-12-9-19(20-8-1-2-10-24-20)16-5-3-7-18(13-16)28(29)30/h1-3,5,7-8,10,13-15,19H,4,6,9,11-12H2,(H,23,27)(H3,22,25,26)