7-methylsulfanyl-3-[[[4-(4-oxidanylpiperidin-1-yl)phenyl]amino]methyl]-1H-quinolin-2-one

Systemtic Name: 7-methylsulfanyl-3-[[[4-(4-oxidanylpiperidin-1-yl)phenyl]amino]methyl]-1H-quinolin-2-one Openeye Name: 3-[[4-(4-hydroxy-1-piperidyl)anilino]methyl]-7-methylsulfanyl-1H-quinolin-2-one CAS Name: 3-[[4-(4-hydroxy-1-piperidinyl)anilino]methyl]-7-(methylthio)-1H-quinolin-2-one IUPAC Name: 3-[[4-(4-hydroxypiperidin-1-yl)anilino]methyl]-7-methylsulfanyl-1H-quinolin-2-one Traditional Name: 3-[[4-(4-hydroxypiperidino)anilino]methyl]-7-(methylthio)carbostyril Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)C=C(C(=O)N2)CNC3=CC=C(C=C3)N4CCC(CC4)O

Isomeric SMILES

CSC1=CC2=C(C=C1)C=C(C(=O)N2)CNC3=CC=C(C=C3)N4CCC(CC4)O

InChI

InChI=1S/C22H25N3O2S/c1-28-20-7-2-15-12-16(22(27)24-21(15)13-20)14-23-17-3-5-18(6-4-17)25-10-8-19(26)9-11-25/h2-7,12-13,19,23,26H,8-11,14H2,1H3,(H,24,27)