2-[[4-(4-methylpiperidin-1-yl)carbothioylphenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-(4-methylpiperidin-1-yl)carbothioylphenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[4-(4-methylpiperidine-1-carbothioyl)phenoxy]methyl]benzonitrile CAS Name: 2-[[4-[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[4-(4-methylpiperidine-1-carbothioyl)phenoxy]methyl]benzonitrile Traditional Name: 2-[[4-(4-methylpiperidine-1-carbothioyl)phenoxy]methyl]benzonitrile Formula: C21H22N2OS MolecularWeight: 350.47718

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)C2=CC=C(C=C2)OCC3=CC=CC=C3C#N

Isomeric SMILES

CC1CCN(CC1)C(=S)C2=CC=C(C=C2)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C21H22N2OS/c1-16-10-12-23(13-11-16)21(25)17-6-8-20(9-7-17)24-15-19-5-3-2-4-18(19)14-22/h2-9,16H,10-13,15H2,1H3