1-[2-[(2-chlorophenyl)methoxy]-7-methylsulfanyl-quinolin-3-yl]-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]methanamine

Systemtic Name: 1-[2-[(2-chlorophenyl)methoxy]-7-methylsulfanyl-quinolin-3-yl]-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]methanamine Openeye Name: 1-[2-[(2-chlorophenyl)methoxy]-7-methylsulfanyl-3-quinolyl]-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]methanamine CAS Name: 1-[2-[(2-chlorophenyl)methoxy]-7-(methylthio)-3-quinolinyl]-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]methanamine IUPAC Name: 1-[2-[(2-chlorophenyl)methoxy]-7-methylsulfanylquinolin-3-yl]-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]methanamine Traditional Name: [2-(2-chlorobenzyl)oxy-7-(methylthio)-3-quinolyl]methyl-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]amine Formula: C23H24ClN4OS+ MolecularWeight: 439.98086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(N1)CNCC2=C(N=C3C=C(C=CC3=C2)SC)OCC4=CC=CC=C4Cl

Isomeric SMILES

CC1=C[NH+]=C(N1)CNCC2=C(N=C3C=C(C=CC3=C2)SC)OCC4=CC=CC=C4Cl

InChI

InChI=1S/C23H23ClN4OS/c1-15-11-26-22(27-15)13-25-12-18-9-16-7-8-19(30-2)10-21(16)28-23(18)29-14-17-5-3-4-6-20(17)24/h3-11,25H,12-14H2,1-2H3,(H,26,27)/p+1