N-[2-[2-[(3aS,6aR)-2-[(1-methylpiperidin-4-yl)methyl]-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-[(3aS,6aR)-2-[(1-methylpiperidin-4-yl)methyl]-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-[(3aS,6aR)-2-[(1-methyl-4-piperidyl)methyl]-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-[(3aS,6aR)-2-[(1-methyl-4-piperidinyl)methyl]-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-[(3aS,6aR)-2-[(1-methylpiperidin-4-yl)methyl]-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-[(3aS,6aR)-2-[(1-methyl-4-piperidyl)methyl]-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: C27H44N4O5S MolecularWeight: 536.72706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N(C)CCOCC(=O)N2CC3CN(CC3C2)CC4CCN(CC4)C)C)OC

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N(C)CCOCC(=O)N2C[C@H]3CN(C[C@H]3C2)CC4CCN(CC4)C)C)OC

InChI

InChI=1S/C27H44N4O5S/c1-20-12-25(35-5)13-21(2)27(20)37(33,34)29(4)10-11-36-19-26(32)31-17-23-15-30(16-24(23)18-31)14-22-6-8-28(3)9-7-22/h12-13,22-24H,6-11,14-19H2,1-5H3/t23-,24+