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

Systemtic Name: 1-[2-(1H-imidazol-5-yl)ethyl]-1-[2-[(4-methyl-2-phenyl-phenyl)methylsulfanyl]ethyl]guanidine Openeye Name: 1-[2-(1H-imidazol-5-yl)ethyl]-1-[2-[(4-methyl-2-phenyl-phenyl)methylsulfanyl]ethyl]guanidine CAS Name: 1-[2-(1H-imidazol-5-yl)ethyl]-1-[2-[(4-methyl-2-phenylphenyl)methylthio]ethyl]guanidine IUPAC Name: 1-[2-(1H-imidazol-5-yl)ethyl]-1-[2-[(4-methyl-2-phenylphenyl)methylsulfanyl]ethyl]guanidine Traditional Name: 1-[2-(1H-imidazol-5-yl)ethyl]-1-[2-[(4-methyl-2-phenyl-benzyl)thio]ethyl]guanidine Formula: C22H27N5S MolecularWeight: 393.54828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CSCCN(CCC2=CN=CN2)C(=N)N)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)CSCCN(CCC2=CN=CN2)C(=N)N)C3=CC=CC=C3

InChI

InChI=1S/C22H27N5S/c1-17-7-8-19(21(13-17)18-5-3-2-4-6-18)15-28-12-11-27(22(23)24)10-9-20-14-25-16-26-20/h2-8,13-14,16H,9-12,15H2,1H3,(H3,23,24)(H,25,26)