2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]-N-methyl-N-(2-morpholin-4-yl-2-oxidanylidene-ethyl)ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCOCC1)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CN(CC(=O)N1CCOCC1)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

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