1-(2,4-dimethylphenyl)sulfonyl-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]piperidine-4-carboxamide Openeye Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]piperidine-4-carboxamide CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[2-[(2-fluorophenyl)methylthio]ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]piperidine-4-carboxamide Traditional Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[2-[(2-fluorobenzyl)thio]ethyl]isonipecotamide Formula: C23H29FN2O3S2 MolecularWeight: 464.616363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCSCC3=CC=CC=C3F)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCSCC3=CC=CC=C3F)C

InChI

InChI=1S/C23H29FN2O3S2/c1-17-7-8-22(18(2)15-17)31(28,29)26-12-9-19(10-13-26)23(27)25-11-14-30-16-20-5-3-4-6-21(20)24/h3-8,15,19H,9-14,16H2,1-2H3,(H,25,27)