4-[[2-[(1S)-1-azanyl-3-methylsulfanyl-propyl]benzimidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[2-[(1S)-1-azanyl-3-methylsulfanyl-propyl]benzimidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[2-[(1S)-1-amino-3-methylsulfanyl-propyl]benzimidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[2-[(1S)-1-amino-3-(methylthio)propyl]-1-benzimidazolyl]methyl]benzonitrile IUPAC Name: 4-[[2-[(1S)-1-amino-3-methylsulfanylpropyl]benzimidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[2-[(1S)-1-amino-3-(methylthio)propyl]benzimidazol-1-yl]methyl]benzonitrile Formula: C19H20N4S MolecularWeight: 336.4539

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)C#N)N

Isomeric SMILES

CSCC[C@@H](C1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)C#N)N

InChI

InChI=1S/C19H20N4S/c1-24-11-10-16(21)19-22-17-4-2-3-5-18(17)23(19)13-15-8-6-14(12-20)7-9-15/h2-9,16H,10-11,13,21H2,1H3/t16-/m0/s1