phenyl 4-pyridin-4-ylsulfanylpiperidine-1-carboxylate

Systemtic Name: phenyl 4-pyridin-4-ylsulfanylpiperidine-1-carboxylate Openeye Name: phenyl 4-(4-pyridylsulfanyl)piperidine-1-carboxylate CAS Name: 4-(pyridin-4-ylthio)-1-piperidinecarboxylic acid phenyl ester IUPAC Name: phenyl 4-pyridin-4-ylsulfanylpiperidine-1-carboxylate Traditional Name: 4-(4-pyridylthio)piperidine-1-carboxylic acid phenyl ester Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1SC2=CC=NC=C2)C(=O)OC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1SC2=CC=NC=C2)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C17H18N2O2S/c20-17(21-14-4-2-1-3-5-14)19-12-8-16(9-13-19)22-15-6-10-18-11-7-15/h1-7,10-11,16H,8-9,12-13H2