N-[3-[[ethanoyl(ethyl)amino]methyl]phenyl]-1-propylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[3-[[ethanoyl(ethyl)amino]methyl]phenyl]-1-propylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[3-[[acetyl(ethyl)amino]methyl]phenyl]-1-propylsulfonyl-piperidine-3-carboxamide CAS Name: N-[3-[[acetyl(ethyl)amino]methyl]phenyl]-1-propylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[3-[[acetyl(ethyl)amino]methyl]phenyl]-1-propylsulfonylpiperidine-3-carboxamide Traditional Name: N-[3-[[acetyl(ethyl)amino]methyl]phenyl]-1-propylsulfonyl-nipecotamide Formula: C20H31N3O4S MolecularWeight: 409.54284

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC2=CC=CC(=C2)CN(CC)C(=O)C

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC2=CC=CC(=C2)CN(CC)C(=O)C

InChI

InChI=1S/C20H31N3O4S/c1-4-12-28(26,27)23-11-7-9-18(15-23)20(25)21-19-10-6-8-17(13-19)14-22(5-2)16(3)24/h6,8,10,13,18H,4-5,7,9,11-12,14-15H2,1-3H3,(H,21,25)