N-[2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(4-benzyl-1-piperidyl)ethyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[2-(4-benzylpiperidin-1-yl)ethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(4-benzylpiperidino)ethyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C24H33N3O3S2 MolecularWeight: 475.66712

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NCCN3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NCCN3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H33N3O3S2/c28-24(22-8-4-13-27(19-22)32(29,30)23-9-5-17-31-23)25-12-16-26-14-10-21(11-15-26)18-20-6-2-1-3-7-20/h1-3,5-7,9,17,21-22H,4,8,10-16,18-19H2,(H,25,28)