1-(4-fluorophenyl)sulfonyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]piperidine-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]piperidine-3-carboxamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-[1-(phenylmethyl)-3-pyrrolidinyl]-3-piperidinecarboxamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-1-(4-fluorophenyl)sulfonyl-nipecotamide Formula: C23H28FN3O3S MolecularWeight: 445.550123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28FN3O3S/c24-20-8-10-22(11-9-20)31(29,30)27-13-4-7-19(16-27)23(28)25-21-12-14-26(17-21)15-18-5-2-1-3-6-18/h1-3,5-6,8-11,19,21H,4,7,12-17H2,(H,25,28)