N-[2-[2-[(3aR,6aS)-2-(1-methylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxidanylidene-ethoxy]ethyl]-4-methoxy-N,2,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[2-[2-[(3aR,6aS)-2-(1-methylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxidanylidene-ethoxy]ethyl]-4-methoxy-N,2,6-trimethyl-benzenesulfonamide Openeye Name: N-[2-[2-[(3aR,6aS)-2-(1-methyl-4-piperidyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxo-ethoxy]ethyl]-4-methoxy-N,2,6-trimethyl-benzenesulfonamide CAS Name: N-[2-[2-[(3aR,6aS)-2-(1-methyl-4-piperidinyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxoethoxy]ethyl]-4-methoxy-N,2,6-trimethylbenzenesulfonamide IUPAC Name: N-[2-[2-[(3aR,6aS)-2-(1-methylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxoethoxy]ethyl]-4-methoxy-N,2,6-trimethylbenzenesulfonamide Traditional Name: N-[2-[2-[(3aR,6aS)-2-(1-methyl-4-piperidyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-keto-ethoxy]ethyl]-4-methoxy-N,2,6-trimethyl-benzenesulfonamide Formula: C26H42N4O5S MolecularWeight: 522.70048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N(C)CCOCC(=O)N2CC3CN(CC3C2)C4CCN(CC4)C)C)OC

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N(C)CCOCC(=O)N2C[C@H]3CN(C[C@H]3C2)C4CCN(CC4)C)C)OC

InChI

InChI=1S/C26H42N4O5S/c1-19-12-24(34-5)13-20(2)26(19)36(32,33)28(4)10-11-35-18-25(31)30-16-21-14-29(15-22(21)17-30)23-6-8-27(3)9-7-23/h12-13,21-23H,6-11,14-18H2,1-5H3/t21-,22+