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

Systemtic Name: 1-[2-(1H-imidazol-5-ylmethylsulfanyl)ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine Openeye Name: 1-[2-(1H-imidazol-5-ylmethylsulfanyl)ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine CAS Name: 1-[2-(1H-imidazol-5-ylmethylthio)ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine IUPAC Name: 1-[2-(1H-imidazol-5-ylmethylsulfanyl)ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine Traditional Name: 1-[2-(1H-imidazol-5-ylmethylthio)ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine Formula: C13H21N7S MolecularWeight: 307.41774

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CCCN=C(N)NCCSCC2=CN=CN2

Isomeric SMILES

C1=C(NC=N1)CCCN=C(N)NCCSCC2=CN=CN2

InChI

InChI=1S/C13H21N7S/c14-13(17-3-1-2-11-6-15-9-19-11)18-4-5-21-8-12-7-16-10-20-12/h6-7,9-10H,1-5,8H2,(H,15,19)(H,16,20)(H3,14,17,18)