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

Systemtic Name: 1-(4-ethoxyphenyl)sulfonyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]piperidine-4-carboxamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-1-(4-ethoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-(4-ethoxyphenyl)sulfonyl-N-[1-(phenylmethyl)-3-pyrrolidinyl]-4-piperidinecarboxamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-1-p-phenetylsulfonyl-isonipecotamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3CCN(C3)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3CCN(C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O4S/c1-2-32-23-8-10-24(11-9-23)33(30,31)28-16-12-21(13-17-28)25(29)26-22-14-15-27(19-22)18-20-6-4-3-5-7-20/h3-11,21-22H,2,12-19H2,1H3,(H,26,29)