N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-oxidanylidene-5-pyrrolidin-1-ylsulfonyl-pyridin-1-yl)ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-oxidanylidene-5-pyrrolidin-1-ylsulfonyl-pyridin-1-yl)ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-oxo-5-pyrrolidin-1-ylsulfonyl-1-pyridyl)acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-oxo-5-(1-pyrrolidinylsulfonyl)-1-pyridinyl]acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-oxo-5-pyrrolidin-1-ylsulfonylpyridin-1-yl)acetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-keto-5-pyrrolidinosulfonyl-1-pyridyl)acetamide Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN(C(=O)C=C2)CC(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN(C(=O)C=C2)CC(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C20H23N3O6S/c24-19(21-15-4-6-17-18(12-15)29-11-3-10-28-17)14-22-13-16(5-7-20(22)25)30(26,27)23-8-1-2-9-23/h4-7,12-13H,1-3,8-11,14H2,(H,21,24)