2-[(2-piperidin-1-ylcarbothioylphenoxy)methyl]benzenecarbonitrile

Systemtic Name: 2-[(2-piperidin-1-ylcarbothioylphenoxy)methyl]benzenecarbonitrile Openeye Name: 2-[[2-(piperidine-1-carbothioyl)phenoxy]methyl]benzonitrile CAS Name: 2-[[2-[1-piperidinyl(sulfanylidene)methyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[2-(piperidine-1-carbothioyl)phenoxy]methyl]benzonitrile Traditional Name: 2-[[2-(piperidine-1-carbothioyl)phenoxy]methyl]benzonitrile Formula: C20H20N2OS MolecularWeight: 336.4506

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=S)C2=CC=CC=C2OCC3=CC=CC=C3C#N

Isomeric SMILES

C1CCN(CC1)C(=S)C2=CC=CC=C2OCC3=CC=CC=C3C#N

InChI

InChI=1S/C20H20N2OS/c21-14-16-8-2-3-9-17(16)15-23-19-11-5-4-10-18(19)20(24)22-12-6-1-7-13-22/h2-5,8-11H,1,6-7,12-13,15H2