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

Systemtic Name: N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-[2-(2-methylpropoxy)-7-methylsulfanyl-quinolin-3-yl]methanamine Openeye Name: 1-(2-isobutoxy-7-methylsulfanyl-3-quinolyl)-N-[(5-methyl-1H-imidazol-2-yl)methyl]methanamine CAS Name: N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-[2-(2-methylpropoxy)-7-(methylthio)-3-quinolinyl]methanamine IUPAC Name: N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-[2-(2-methylpropoxy)-7-methylsulfanylquinolin-3-yl]methanamine Traditional Name: [2-isobutoxy-7-(methylthio)-3-quinolyl]methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amine Formula: C20H26N4OS MolecularWeight: 370.51164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N1)CNCC2=C(N=C3C=C(C=CC3=C2)SC)OCC(C)C

Isomeric SMILES

CC1=CN=C(N1)CNCC2=C(N=C3C=C(C=CC3=C2)SC)OCC(C)C

InChI

InChI=1S/C20H26N4OS/c1-13(2)12-25-20-16(10-21-11-19-22-9-14(3)23-19)7-15-5-6-17(26-4)8-18(15)24-20/h5-9,13,21H,10-12H2,1-4H3,(H,22,23)