N-[1-(phenylmethyl)pyrrolidin-3-yl]-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(phenylmethyl)pyrrolidin-3-yl]-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-1-(4-isopropylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(phenylmethyl)-3-pyrrolidinyl]-1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-1-p-cumenylsulfonyl-isonipecotamide Formula: C26H35N3O3S MolecularWeight: 469.6394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H35N3O3S/c1-20(2)22-8-10-25(11-9-22)33(31,32)29-16-12-23(13-17-29)26(30)27-24-14-15-28(19-24)18-21-6-4-3-5-7-21/h3-11,20,23-24H,12-19H2,1-2H3,(H,27,30)