N-methyl-N-[(1S)-2-(3-oxidanylpyrrolidin-1-yl)-1-phenyl-ethyl]-2-(6-pyrrolidin-1-ylsulfonyl-1,3-benzodioxol-5-yl)ethanamide

Systemtic Name: N-methyl-N-[(1S)-2-(3-oxidanylpyrrolidin-1-yl)-1-phenyl-ethyl]-2-(6-pyrrolidin-1-ylsulfonyl-1,3-benzodioxol-5-yl)ethanamide Openeye Name: N-[(1S)-2-(3-hydroxypyrrolidin-1-yl)-1-phenyl-ethyl]-N-methyl-2-(6-pyrrolidin-1-ylsulfonyl-1,3-benzodioxol-5-yl)acetamide CAS Name: N-[(1S)-2-(3-hydroxy-1-pyrrolidinyl)-1-phenylethyl]-N-methyl-2-[6-(1-pyrrolidinylsulfonyl)-1,3-benzodioxol-5-yl]acetamide IUPAC Name: N-[(1S)-2-(3-hydroxypyrrolidin-1-yl)-1-phenylethyl]-N-methyl-2-(6-pyrrolidin-1-ylsulfonyl-1,3-benzodioxol-5-yl)acetamide Traditional Name: N-[(1S)-2-(3-hydroxypyrrolidino)-1-phenyl-ethyl]-N-methyl-2-(6-pyrrolidinosulfonyl-1,3-benzodioxol-5-yl)acetamide Formula: C26H33N3O6S MolecularWeight: 515.62172

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CN1CCC(C1)O)C2=CC=CC=C2)C(=O)CC3=CC4=C(C=C3S(=O)(=O)N5CCCC5)OCO4

Isomeric SMILES

CN([C@H](CN1CCC(C1)O)C2=CC=CC=C2)C(=O)CC3=CC4=C(C=C3S(=O)(=O)N5CCCC5)OCO4

InChI

InChI=1S/C26H33N3O6S/c1-27(22(19-7-3-2-4-8-19)17-28-12-9-21(30)16-28)26(31)14-20-13-23-24(35-18-34-23)15-25(20)36(32,33)29-10-5-6-11-29/h2-4,7-8,13,15,21-22,30H,5-6,9-12,14,16-18H2,1H3/t21?,22-/m1/s1