N-(2-methoxyethyl)-N-[(7-methylsulfanyl-2-morpholin-4-yl-quinolin-3-yl)methyl]-2-(trifluoromethyl)benzamide

Systemtic Name: N-(2-methoxyethyl)-N-[(7-methylsulfanyl-2-morpholin-4-yl-quinolin-3-yl)methyl]-2-(trifluoromethyl)benzamide Openeye Name: N-(2-methoxyethyl)-N-[(7-methylsulfanyl-2-morpholino-3-quinolyl)methyl]-2-(trifluoromethyl)benzamide CAS Name: N-(2-methoxyethyl)-N-[[7-(methylthio)-2-(4-morpholinyl)-3-quinolinyl]methyl]-2-(trifluoromethyl)benzamide IUPAC Name: N-(2-methoxyethyl)-N-[(7-methylsulfanyl-2-morpholin-4-ylquinolin-3-yl)methyl]-2-(trifluoromethyl)benzamide Traditional Name: N-(2-methoxyethyl)-N-[[7-(methylthio)-2-morpholino-3-quinolyl]methyl]-2-(trifluoromethyl)benzamide Formula: C26H28F3N3O3S MolecularWeight: 519.57903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=C(N=C2C=C(C=CC2=C1)SC)N3CCOCC3)C(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

COCCN(CC1=C(N=C2C=C(C=CC2=C1)SC)N3CCOCC3)C(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C26H28F3N3O3S/c1-34-12-9-32(25(33)21-5-3-4-6-22(21)26(27,28)29)17-19-15-18-7-8-20(36-2)16-23(18)30-24(19)31-10-13-35-14-11-31/h3-8,15-16H,9-14,17H2,1-2H3