N-[1-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[1-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[1-methyl-2-[4-(2-morpholino-2-oxo-ethyl)piperazin-1-yl]-2-oxo-ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[1-[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazinyl]-1-oxopropan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[1-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]-1-oxopropan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[2-keto-2-[4-(2-keto-2-morpholino-ethyl)piperazino]-1-methyl-ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C22H32N4O7S MolecularWeight: 496.57708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC(=O)N2CCOCC2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CC(=O)N2CCOCC2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C22H32N4O7S/c1-17(23-34(29,30)18-3-4-19-20(15-18)33-12-2-11-32-19)22(28)26-7-5-24(6-8-26)16-21(27)25-9-13-31-14-10-25/h3-4,15,17,23H,2,5-14,16H2,1H3