2-(3-imidazol-1-ylpropyl)-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine trihydrochloride

Systemtic Name: 2-(3-imidazol-1-ylpropyl)-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine trihydrochloride Openeye Name: 2-(3-imidazol-1-ylpropyl)-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine trihydrochloride CAS Name: 2-[3-(1-imidazolyl)propyl]-1-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]guanidine trihydrochloride IUPAC Name: 2-(3-imidazol-1-ylpropyl)-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine trihydrochloride Traditional Name: 2-(3-imidazol-1-ylpropyl)-1-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]guanidine trihydrochloride Formula: C14H26Cl3N7S MolecularWeight: 430.82714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNC(=NCCCN2C=CN=C2)N.Cl.Cl.Cl

Isomeric SMILES

CC1=C(N=CN1)CSCCNC(=NCCCN2C=CN=C2)N.Cl.Cl.Cl

InChI

InChI=1S/C14H23N7S.3ClH/c1-12-13(20-10-19-12)9-22-8-5-18-14(15)17-3-2-6-21-7-4-16-11-21;;;/h4,7,10-11H,2-3,5-6,8-9H2,1H3,(H,19,20)(H3,15,17,18);3*1H