4-chloranyl-2-[3-(dimethylaminomethyl)-2-methylsulfanyl-phenoxy]benzenecarbonitrile

Systemtic Name: 4-chloranyl-2-[3-(dimethylaminomethyl)-2-methylsulfanyl-phenoxy]benzenecarbonitrile Openeye Name: 4-chloro-2-[3-(dimethylaminomethyl)-2-methylsulfanyl-phenoxy]benzonitrile CAS Name: 4-chloro-2-[3-(dimethylaminomethyl)-2-(methylthio)phenoxy]benzonitrile IUPAC Name: 4-chloro-2-[3-(dimethylaminomethyl)-2-methylsulfanylphenoxy]benzonitrile Traditional Name: 4-chloro-2-[3-(dimethylaminomethyl)-2-(methylthio)phenoxy]benzonitrile Formula: C17H17ClN2OS MolecularWeight: 332.84768

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(C(=CC=C1)OC2=C(C=CC(=C2)Cl)C#N)SC

Isomeric SMILES

CN(C)CC1=C(C(=CC=C1)OC2=C(C=CC(=C2)Cl)C#N)SC

InChI

InChI=1S/C17H17ClN2OS/c1-20(2)11-13-5-4-6-15(17(13)22-3)21-16-9-14(18)8-7-12(16)10-19/h4-9H,11H2,1-3H3