N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(2-oxopyrrolidin-1-yl)propyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(2-oxo-1-pyrrolidinyl)propyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(2-oxopyrrolidin-1-yl)propyl]-1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(2-ketopyrrolidino)propyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-isonipecotamide Formula: C23H35N3O4S MolecularWeight: 449.6067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NCCCN3CCCC3=O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NCCCN3CCCC3=O)C)C

InChI

InChI=1S/C23H35N3O4S/c1-16-15-17(2)19(4)22(18(16)3)31(29,30)26-13-8-20(9-14-26)23(28)24-10-6-12-25-11-5-7-21(25)27/h15,20H,5-14H2,1-4H3,(H,24,28)