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

Systemtic Name: 1-[3-(3-aminophenyl)-3-pyridin-2-yl-propyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine Openeye Name: 1-[3-(3-aminophenyl)-3-(2-pyridyl)propyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine CAS Name: 1-[3-(3-aminophenyl)-3-(2-pyridinyl)propyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine IUPAC Name: 1-[3-(3-aminophenyl)-3-pyridin-2-ylpropyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine Traditional Name: 1-[3-(3-aminophenyl)-3-(2-pyridyl)propyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine Formula: C21H27N7 MolecularWeight: 377.48598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N7/c22-17-6-3-5-16(13-17)19(20-8-1-2-10-25-20)9-12-27-21(23)26-11-4-7-18-14-24-15-28-18/h1-3,5-6,8,10,13-15,19H,4,7,9,11-12,22H2,(H,24,28)(H3,23,26,27)