(5,6-dimethyl-1H-benzimidazol-2-yl)methyl-methyl-[[5-methyl-2-(4-methylsulfanylphenyl)-1,3-oxazol-4-yl]methyl]azanium

Systemtic Name: (5,6-dimethyl-1H-benzimidazol-2-yl)methyl-methyl-[[5-methyl-2-(4-methylsulfanylphenyl)-1,3-oxazol-4-yl]methyl]azanium Openeye Name: (5,6-dimethyl-1H-benzimidazol-2-yl)methyl-methyl-[[5-methyl-2-(4-methylsulfanylphenyl)oxazol-4-yl]methyl]ammonium CAS Name: (5,6-dimethyl-1H-benzimidazol-2-yl)methyl-methyl-[[5-methyl-2-[4-(methylthio)phenyl]-4-oxazolyl]methyl]ammonium IUPAC Name: (5,6-dimethyl-1H-benzimidazol-2-yl)methyl-methyl-[[5-methyl-2-(4-methylsulfanylphenyl)-1,3-oxazol-4-yl]methyl]azanium Traditional Name: (5,6-dimethyl-1H-benzimidazol-2-yl)methyl-methyl-[[5-methyl-2-[4-(methylthio)phenyl]oxazol-4-yl]methyl]ammonium Formula: C23H27N4OS+ MolecularWeight: 407.55168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)C[NH+](C)CC3=C(OC(=N3)C4=CC=C(C=C4)SC)C

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C[NH+](C)CC3=C(OC(=N3)C4=CC=C(C=C4)SC)C

InChI

InChI=1S/C23H26N4OS/c1-14-10-19-20(11-15(14)2)25-22(24-19)13-27(4)12-21-16(3)28-23(26-21)17-6-8-18(29-5)9-7-17/h6-11H,12-13H2,1-5H3,(H,24,25)/p+1