phenyl 4-[4-(piperidin-1-ylmethyl)phenyl]sulfanylpiperidine-1-carboxylate

Systemtic Name: phenyl 4-[4-(piperidin-1-ylmethyl)phenyl]sulfanylpiperidine-1-carboxylate Openeye Name: phenyl 4-[4-(1-piperidylmethyl)phenyl]sulfanylpiperidine-1-carboxylate CAS Name: 4-[[4-(1-piperidinylmethyl)phenyl]thio]-1-piperidinecarboxylic acid phenyl ester IUPAC Name: phenyl 4-[4-(piperidin-1-ylmethyl)phenyl]sulfanylpiperidine-1-carboxylate Traditional Name: 4-[[4-(piperidinomethyl)phenyl]thio]piperidine-1-carboxylic acid phenyl ester Formula: C24H30N2O2S MolecularWeight: 410.5722

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)SC3CCN(CC3)C(=O)OC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)SC3CCN(CC3)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C24H30N2O2S/c27-24(28-21-7-3-1-4-8-21)26-17-13-23(14-18-26)29-22-11-9-20(10-12-22)19-25-15-5-2-6-16-25/h1,3-4,7-12,23H,2,5-6,13-19H2