tert-butyl 4-(4-propan-2-ylsulfanylphenyl)carbonylpiperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-propan-2-ylsulfanylphenyl)carbonylpiperidine-1-carboxylate Openeye Name: tert-butyl 4-(4-isopropylsulfanylbenzoyl)piperidine-1-carboxylate CAS Name: 4-[oxo-[4-(propan-2-ylthio)phenyl]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-propan-2-ylsulfanylbenzoyl)piperidine-1-carboxylate Traditional Name: 4-[4-(isopropylthio)benzoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H29NO3S MolecularWeight: 363.51416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H29NO3S/c1-14(2)25-17-8-6-15(7-9-17)18(22)16-10-12-21(13-11-16)19(23)24-20(3,4)5/h6-9,14,16H,10-13H2,1-5H3