(phenylmethyl) 4-[4-(dimethylaminomethyl)phenyl]sulfanylpiperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[4-(dimethylaminomethyl)phenyl]sulfanylpiperidine-1-carboxylate Openeye Name: benzyl 4-[4-(dimethylaminomethyl)phenyl]sulfanylpiperidine-1-carboxylate CAS Name: 4-[[4-(dimethylaminomethyl)phenyl]thio]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[4-(dimethylaminomethyl)phenyl]sulfanylpiperidine-1-carboxylate Traditional Name: 4-[[4-(dimethylaminomethyl)phenyl]thio]piperidine-1-carboxylic acid benzyl ester Formula: C22H28N2O2S MolecularWeight: 384.53492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(C=C1)SC2CCN(CC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN(C)CC1=CC=C(C=C1)SC2CCN(CC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O2S/c1-23(2)16-18-8-10-20(11-9-18)27-21-12-14-24(15-13-21)22(25)26-17-19-6-4-3-5-7-19/h3-11,21H,12-17H2,1-2H3