tert-butyl 4-(2-phenylsulfanylethylcarbamoyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-phenylsulfanylethylcarbamoyl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(2-phenylsulfanylethylcarbamoyl)piperidine-1-carboxylate CAS Name: 4-[oxo-[2-(phenylthio)ethylamino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-phenylsulfanylethylcarbamoyl)piperidine-1-carboxylate Traditional Name: 4-[2-(phenylthio)ethylcarbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H28N2O3S MolecularWeight: 364.50222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C19H28N2O3S/c1-19(2,3)24-18(23)21-12-9-15(10-13-21)17(22)20-11-14-25-16-7-5-4-6-8-16/h4-8,15H,9-14H2,1-3H3,(H,20,22)