4-[4-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[(2-chloro-7-methylsulfanyl-3-quinolyl)methoxy]phenyl]benzonitrile CAS Name: 4-[4-[[2-chloro-7-(methylthio)-3-quinolinyl]methoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[(2-chloro-7-methylsulfanylquinolin-3-yl)methoxy]phenyl]benzonitrile Traditional Name: 4-[4-[[2-chloro-7-(methylthio)-3-quinolyl]methoxy]phenyl]benzonitrile Formula: C24H17ClN2OS MolecularWeight: 416.92258

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)COC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)COC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)Cl

InChI

InChI=1S/C24H17ClN2OS/c1-29-22-11-8-19-12-20(24(25)27-23(19)13-22)15-28-21-9-6-18(7-10-21)17-4-2-16(14-26)3-5-17/h2-13H,15H2,1H3