1,2-bis[3-(1H-imidazol-5-ylmethylsulfanyl)propyl]-1-methyl-guanidine

Systemtic Name: 1,2-bis[3-(1H-imidazol-5-ylmethylsulfanyl)propyl]-1-methyl-guanidine Openeye Name: 1,2-bis[3-(1H-imidazol-5-ylmethylsulfanyl)propyl]-1-methyl-guanidine CAS Name: 1,2-bis[3-(1H-imidazol-5-ylmethylthio)propyl]-1-methylguanidine IUPAC Name: 1,2-bis[3-(1H-imidazol-5-ylmethylsulfanyl)propyl]-1-methylguanidine Traditional Name: 1,2-bis[3-(1H-imidazol-5-ylmethylthio)propyl]-1-methyl-guanidine Formula: C16H27N7S2 MolecularWeight: 381.56248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCSCC1=CN=CN1)C(=NCCCSCC2=CN=CN2)N

Isomeric SMILES

CN(CCCSCC1=CN=CN1)C(=NCCCSCC2=CN=CN2)N

InChI

InChI=1S/C16H27N7S2/c1-23(5-3-7-25-11-15-9-19-13-22-15)16(17)20-4-2-6-24-10-14-8-18-12-21-14/h8-9,12-13H,2-7,10-11H2,1H3,(H2,17,20)(H,18,21)(H,19,22)