2-(12-azanyldodecyl)-1-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine

Systemtic Name: 2-(12-azanyldodecyl)-1-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine Openeye Name: 2-(12-aminododecyl)-1-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine CAS Name: 2-(12-aminododecyl)-1-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]guanidine IUPAC Name: 2-(12-aminododecyl)-1-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine Traditional Name: 2-(12-aminododecyl)-1-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]guanidine Formula: C21H39N7S MolecularWeight: 421.64626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCN(C#N)C(=NCCCCCCCCCCCCN)N

Isomeric SMILES

CC1=C(N=CN1)CSCCN(C#N)C(=NCCCCCCCCCCCCN)N

InChI

InChI=1S/C21H39N7S/c1-19-20(27-18-26-19)16-29-15-14-28(17-23)21(24)25-13-11-9-7-5-3-2-4-6-8-10-12-22/h18H,2-16,22H2,1H3,(H2,24,25)(H,26,27)