1-(4-ethanoylphenyl)sulfonyl-N-(2-pyrrolidin-1-ylbutyl)piperidine-4-carboxamide

Systemtic Name: 1-(4-ethanoylphenyl)sulfonyl-N-(2-pyrrolidin-1-ylbutyl)piperidine-4-carboxamide Openeye Name: 1-(4-acetylphenyl)sulfonyl-N-(2-pyrrolidin-1-ylbutyl)piperidine-4-carboxamide CAS Name: 1-(4-acetylphenyl)sulfonyl-N-[2-(1-pyrrolidinyl)butyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-acetylphenyl)sulfonyl-N-(2-pyrrolidin-1-ylbutyl)piperidine-4-carboxamide Traditional Name: 1-(4-acetylphenyl)sulfonyl-N-(2-pyrrolidinobutyl)isonipecotamide Formula: C22H33N3O4S MolecularWeight: 435.58012

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)C)N3CCCC3

Isomeric SMILES

CCC(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)C)N3CCCC3

InChI

InChI=1S/C22H33N3O4S/c1-3-20(24-12-4-5-13-24)16-23-22(27)19-10-14-25(15-11-19)30(28,29)21-8-6-18(7-9-21)17(2)26/h6-9,19-20H,3-5,10-16H2,1-2H3,(H,23,27)