1-methylsulfonyl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-methylsulfonyl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-methylsulfonyl-N-[3-(1-pyrrolidinylmethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-methylsulfonyl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-mesyl-N-[3-(pyrrolidinomethyl)phenyl]isonipecotamide Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)CN3CCCC3

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)CN3CCCC3

InChI

InChI=1S/C18H27N3O3S/c1-25(23,24)21-11-7-16(8-12-21)18(22)19-17-6-4-5-15(13-17)14-20-9-2-3-10-20/h4-6,13,16H,2-3,7-12,14H2,1H3,(H,19,22)