N-[[2-(2-methylpropoxy)-7-methylsulfanyl-quinolin-3-yl]methyl]-1-pyridin-4-yl-methanamine

Systemtic Name: N-[[2-(2-methylpropoxy)-7-methylsulfanyl-quinolin-3-yl]methyl]-1-pyridin-4-yl-methanamine Openeye Name: N-[(2-isobutoxy-7-methylsulfanyl-3-quinolyl)methyl]-1-(4-pyridyl)methanamine CAS Name: N-[[2-(2-methylpropoxy)-7-(methylthio)-3-quinolinyl]methyl]-1-pyridin-4-ylmethanamine IUPAC Name: N-[[2-(2-methylpropoxy)-7-methylsulfanylquinolin-3-yl]methyl]-1-pyridin-4-ylmethanamine Traditional Name: [2-isobutoxy-7-(methylthio)-3-quinolyl]methyl-(4-pyridylmethyl)amine Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C2C=CC(=CC2=N1)SC)CNCC3=CC=NC=C3

Isomeric SMILES

CC(C)COC1=C(C=C2C=CC(=CC2=N1)SC)CNCC3=CC=NC=C3

InChI

InChI=1S/C21H25N3OS/c1-15(2)14-25-21-18(13-23-12-16-6-8-22-9-7-16)10-17-4-5-19(26-3)11-20(17)24-21/h4-11,15,23H,12-14H2,1-3H3