N-[(4-methylsulfanylphenyl)-(8-oxidanylquinolin-7-yl)methyl]butanamide

Systemtic Name: N-[(4-methylsulfanylphenyl)-(8-oxidanylquinolin-7-yl)methyl]butanamide Openeye Name: N-[(8-hydroxy-7-quinolyl)-(4-methylsulfanylphenyl)methyl]butanamide CAS Name: N-[(8-hydroxy-7-quinolinyl)-[4-(methylthio)phenyl]methyl]butanamide IUPAC Name: N-[(8-hydroxyquinolin-7-yl)-(4-methylsulfanylphenyl)methyl]butanamide Traditional Name: N-[(8-hydroxy-7-quinolyl)-[4-(methylthio)phenyl]methyl]butyramide Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(C1=CC=C(C=C1)SC)C2=C(C3=C(C=CC=N3)C=C2)O

Isomeric SMILES

CCCC(=O)NC(C1=CC=C(C=C1)SC)C2=C(C3=C(C=CC=N3)C=C2)O

InChI

InChI=1S/C21H22N2O2S/c1-3-5-18(24)23-19(15-7-10-16(26-2)11-8-15)17-12-9-14-6-4-13-22-20(14)21(17)25/h4,6-13,19,25H,3,5H2,1-2H3,(H,23,24)