2-[(4-piperidin-1-ylcarbothioylphenoxy)methyl]benzenecarbonitrile

Systemtic Name: 2-[(4-piperidin-1-ylcarbothioylphenoxy)methyl]benzenecarbonitrile Openeye Name: 2-[[4-(piperidine-1-carbothioyl)phenoxy]methyl]benzonitrile CAS Name: 2-[[4-[1-piperidinyl(sulfanylidene)methyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[4-(piperidine-1-carbothioyl)phenoxy]methyl]benzonitrile Traditional Name: 2-[[4-(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=C(C=C2)OCC3=CC=CC=C3C#N

Isomeric SMILES

C1CCN(CC1)C(=S)C2=CC=C(C=C2)OCC3=CC=CC=C3C#N

InChI

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