(3S)-1-(phenylmethyl)sulfonyl-N-(2-pyridin-2-ylethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(phenylmethyl)sulfonyl-N-(2-pyridin-2-ylethyl)piperidine-3-carboxamide Openeye Name: (3S)-1-benzylsulfonyl-N-[2-(2-pyridyl)ethyl]piperidine-3-carboxamide CAS Name: (3S)-1-(phenylmethyl)sulfonyl-N-[2-(2-pyridinyl)ethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-benzylsulfonyl-N-(2-pyridin-2-ylethyl)piperidine-3-carboxamide Traditional Name: (3S)-1-benzylsulfonyl-N-[2-(2-pyridyl)ethyl]nipecotamide Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CC2=CC=CC=C2)C(=O)NCCC3=CC=CC=N3

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)CC2=CC=CC=C2)C(=O)NCCC3=CC=CC=N3

InChI

InChI=1S/C20H25N3O3S/c24-20(22-13-11-19-10-4-5-12-21-19)18-9-6-14-23(15-18)27(25,26)16-17-7-2-1-3-8-17/h1-5,7-8,10,12,18H,6,9,11,13-16H2,(H,22,24)/t18-/m0/s1