1-cyano-2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-1-propyl-guanidine

Systemtic Name: 1-cyano-2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-1-propyl-guanidine Openeye Name: 1-cyano-2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-1-propyl-guanidine CAS Name: 1-cyano-2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-1-propylguanidine IUPAC Name: 1-cyano-2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-1-propylguanidine Traditional Name: 1-cyano-2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-1-propyl-guanidine Formula: C12H20N6S MolecularWeight: 280.3924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(C#N)C(=NCCSCC1=C(NC=N1)C)N

Isomeric SMILES

CCCN(C#N)C(=NCCSCC1=C(NC=N1)C)N

InChI

InChI=1S/C12H20N6S/c1-3-5-18(8-13)12(14)15-4-6-19-7-11-10(2)16-9-17-11/h9H,3-7H2,1-2H3,(H2,14,15)(H,16,17)