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

Systemtic Name: 2-(4-azanylbutyl)-1-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine Openeye Name: 2-(4-aminobutyl)-1-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine CAS Name: 2-(4-aminobutyl)-1-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]guanidine IUPAC Name: 2-(4-aminobutyl)-1-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine Traditional Name: 2-(4-aminobutyl)-1-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]guanidine Formula: C13H23N7S MolecularWeight: 309.43362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23N7S/c1-11-12(19-10-18-11)8-21-7-6-20(9-15)13(16)17-5-3-2-4-14/h10H,2-8,14H2,1H3,(H2,16,17)(H,18,19)