N-(3-phenylsulfanylpropyl)-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-phenylsulfanylpropyl)-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-isopropylphenyl)sulfonyl-N-(3-phenylsulfanylpropyl)piperidine-4-carboxamide CAS Name: N-[3-(phenylthio)propyl]-1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-phenylsulfanylpropyl)-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-p-cumenylsulfonyl-N-[3-(phenylthio)propyl]isonipecotamide Formula: C24H32N2O3S2 MolecularWeight: 460.65248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C24H32N2O3S2/c1-19(2)20-9-11-23(12-10-20)31(28,29)26-16-13-21(14-17-26)24(27)25-15-6-18-30-22-7-4-3-5-8-22/h3-5,7-12,19,21H,6,13-18H2,1-2H3,(H,25,27)