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

Systemtic Name: 1-[2-(2-methylpropoxy)-7-methylsulfanyl-quinolin-3-yl]-N-[(5-methylpyrazin-2-yl)methyl]methanamine Openeye Name: 1-(2-isobutoxy-7-methylsulfanyl-3-quinolyl)-N-[(5-methylpyrazin-2-yl)methyl]methanamine CAS Name: 1-[2-(2-methylpropoxy)-7-(methylthio)-3-quinolinyl]-N-[(5-methyl-2-pyrazinyl)methyl]methanamine IUPAC Name: 1-[2-(2-methylpropoxy)-7-methylsulfanylquinolin-3-yl]-N-[(5-methylpyrazin-2-yl)methyl]methanamine Traditional Name: [2-isobutoxy-7-(methylthio)-3-quinolyl]methyl-[(5-methylpyrazin-2-yl)methyl]amine Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4OS/c1-14(2)13-26-21-17(10-22-11-18-12-23-15(3)9-24-18)7-16-5-6-19(27-4)8-20(16)25-21/h5-9,12,14,22H,10-11,13H2,1-4H3