N-[[2-(4-chlorophenyl)-7-methylsulfanyl-quinolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)propanamide

Systemtic Name: N-[[2-(4-chlorophenyl)-7-methylsulfanyl-quinolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)propanamide Openeye Name: N-[[2-(4-chlorophenyl)-7-methylsulfanyl-3-quinolyl]methyl]-N-(tetrahydrofuran-2-ylmethyl)propanamide CAS Name: N-[[2-(4-chlorophenyl)-7-(methylthio)-3-quinolinyl]methyl]-N-(2-oxolanylmethyl)propanamide IUPAC Name: N-[[2-(4-chlorophenyl)-7-methylsulfanylquinolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)propanamide Traditional Name: N-[[2-(4-chlorophenyl)-7-(methylthio)-3-quinolyl]methyl]-N-(tetrahydrofurfuryl)propionamide Formula: C25H27ClN2O2S MolecularWeight: 455.01208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC1CCCO1)CC2=C(N=C3C=C(C=CC3=C2)SC)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCC(=O)N(CC1CCCO1)CC2=C(N=C3C=C(C=CC3=C2)SC)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H27ClN2O2S/c1-3-24(29)28(16-21-5-4-12-30-21)15-19-13-18-8-11-22(31-2)14-23(18)27-25(19)17-6-9-20(26)10-7-17/h6-11,13-14,21H,3-5,12,15-16H2,1-2H3