1-[2-[(3-bromanylpyridin-2-yl)methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine

Systemtic Name: 1-[2-[(3-bromanylpyridin-2-yl)methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine Openeye Name: 1-[2-[(3-bromo-2-pyridyl)methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine CAS Name: 1-[2-[(3-bromo-2-pyridinyl)methylthio]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine IUPAC Name: 1-[2-[(3-bromopyridin-2-yl)methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine Traditional Name: 1-[2-[(3-bromo-2-pyridyl)methylthio]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine Formula: C15H21BrN6S MolecularWeight: 397.33644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)CSCCNC(=NCCCC2=CN=CN2)N)Br

Isomeric SMILES

C1=CC(=C(N=C1)CSCCNC(=NCCCC2=CN=CN2)N)Br

InChI

InChI=1S/C15H21BrN6S/c16-13-4-2-5-19-14(13)10-23-8-7-21-15(17)20-6-1-3-12-9-18-11-22-12/h2,4-5,9,11H,1,3,6-8,10H2,(H,18,22)(H3,17,20,21)