3-(dimethylaminomethyl)-4-(4-methylsulfanylphenoxy)benzenecarbonitrile

Systemtic Name: 3-(dimethylaminomethyl)-4-(4-methylsulfanylphenoxy)benzenecarbonitrile Openeye Name: 3-(dimethylaminomethyl)-4-(4-methylsulfanylphenoxy)benzonitrile CAS Name: 3-(dimethylaminomethyl)-4-[4-(methylthio)phenoxy]benzonitrile IUPAC Name: 3-(dimethylaminomethyl)-4-(4-methylsulfanylphenoxy)benzonitrile Traditional Name: 3-(dimethylaminomethyl)-4-[4-(methylthio)phenoxy]benzonitrile Formula: C17H18N2OS MolecularWeight: 298.40262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2OS/c1-19(2)12-14-10-13(11-18)4-9-17(14)20-15-5-7-16(21-3)8-6-15/h4-10H,12H2,1-3H3