1-methoxy-1,2-bis[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine trihydrochloride

Systemtic Name: 1-methoxy-1,2-bis[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine trihydrochloride Openeye Name: 1-methoxy-1,2-bis[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine trihydrochloride CAS Name: 1-methoxy-1,2-bis[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]guanidine trihydrochloride IUPAC Name: 1-methoxy-1,2-bis[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine trihydrochloride Traditional Name: 1-methoxy-1,2-bis[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]guanidine trihydrochloride Formula: C16H30Cl3N7OS2 MolecularWeight: 506.9447

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCN=C(N)N(CCSCC2=C(NC=N2)C)OC.Cl.Cl.Cl

Isomeric SMILES

CC1=C(N=CN1)CSCCN=C(N)N(CCSCC2=C(NC=N2)C)OC.Cl.Cl.Cl

InChI

InChI=1S/C16H27N7OS2.3ClH/c1-12-14(21-10-19-12)8-25-6-4-18-16(17)23(24-3)5-7-26-9-15-13(2)20-11-22-15;;;/h10-11H,4-9H2,1-3H3,(H2,17,18)(H,19,21)(H,20,22);3*1H