methyl 2,2,6,6-tetramethyl-4-(phenylsulfanylcarbamoylamino)piperidine-4-carboxylate

Systemtic Name: methyl 2,2,6,6-tetramethyl-4-(phenylsulfanylcarbamoylamino)piperidine-4-carboxylate Openeye Name: methyl 2,2,6,6-tetramethyl-4-(phenylsulfanylcarbamoylamino)piperidine-4-carboxylate CAS Name: 2,2,6,6-tetramethyl-4-[[oxo-[(phenylthio)amino]methyl]amino]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 2,2,6,6-tetramethyl-4-(phenylsulfanylcarbamoylamino)piperidine-4-carboxylate Traditional Name: 2,2,6,6-tetramethyl-4-[(phenylthio)carbamoylamino]isonipecotic acid methyl ester Formula: C18H27N3O3S MolecularWeight: 365.49028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(N1)(C)C)(C(=O)OC)NC(=O)NSC2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(CC(N1)(C)C)(C(=O)OC)NC(=O)NSC2=CC=CC=C2)C

InChI

InChI=1S/C18H27N3O3S/c1-16(2)11-18(14(22)24-5,12-17(3,4)21-16)19-15(23)20-25-13-9-7-6-8-10-13/h6-10,21H,11-12H2,1-5H3,(H2,19,20,23)