N-[1-(phenylmethyl)pyrrolidin-3-yl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-[1-(phenylmethyl)pyrrolidin-3-yl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(1-benzylpyrrolidin-3-yl)piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[1-(phenylmethyl)-3-pyrrolidinyl]-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(1-benzylpyrrolidin-3-yl)piperidine-3-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-1-besyl-nipecotamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3CCN(C3)CC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3CCN(C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H29N3O3S/c27-23(24-21-13-15-25(18-21)16-19-8-3-1-4-9-19)20-10-7-14-26(17-20)30(28,29)22-11-5-2-6-12-22/h1-6,8-9,11-12,20-21H,7,10,13-18H2,(H,24,27)