1-ethylsulfonyl-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-ethylsulfonyl-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-ethylsulfonyl-N-[(2-pyrrolidin-1-yl-4-pyridyl)methyl]piperidine-4-carboxamide CAS Name: 1-ethylsulfonyl-N-[[2-(1-pyrrolidinyl)-4-pyridinyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-ethylsulfonyl-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-esyl-N-[(2-pyrrolidino-4-pyridyl)methyl]isonipecotamide Formula: C18H28N4O3S MolecularWeight: 380.50492

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NCC2=CC(=NC=C2)N3CCCC3

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NCC2=CC(=NC=C2)N3CCCC3

InChI

InChI=1S/C18H28N4O3S/c1-2-26(24,25)22-11-6-16(7-12-22)18(23)20-14-15-5-8-19-17(13-15)21-9-3-4-10-21/h5,8,13,16H,2-4,6-7,9-12,14H2,1H3,(H,20,23)