1-(3-phenylpropylsulfonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide

Systemtic Name: 1-(3-phenylpropylsulfonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide Openeye Name: 1-(3-phenylpropylsulfonyl)-N-(3-pyridylmethyl)piperidine-3-carboxamide CAS Name: 1-(3-phenylpropylsulfonyl)-N-(3-pyridinylmethyl)-3-piperidinecarboxamide IUPAC Name: 1-(3-phenylpropylsulfonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide Traditional Name: 1-(3-phenylpropylsulfonyl)-N-(3-pyridylmethyl)nipecotamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CCCC2=CC=CC=C2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)CCCC2=CC=CC=C2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C21H27N3O3S/c25-21(23-16-19-9-4-12-22-15-19)20-11-5-13-24(17-20)28(26,27)14-6-10-18-7-2-1-3-8-18/h1-4,7-9,12,15,20H,5-6,10-11,13-14,16-17H2,(H,23,25)