2-[[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-amino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-amino]-N-propan-2-yl-ethanamide Openeye Name: 2-[[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-2-oxo-ethyl]-methyl-amino]-N-isopropyl-acetamide CAS Name: 2-[[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinyl]-2-oxoethyl]-methylamino]-N-propan-2-ylacetamide IUPAC Name: 2-[[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-2-oxoethyl]-methylamino]-N-propan-2-ylacetamide Traditional Name: 2-[[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazino]-2-keto-ethyl]-methyl-amino]-N-isopropyl-acetamide Formula: C20H30N4O6S MolecularWeight: 454.5404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN(C)CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)NC(=O)CN(C)CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H30N4O6S/c1-15(2)21-19(25)13-22(3)14-20(26)23-6-8-24(9-7-23)31(27,28)16-4-5-17-18(12-16)30-11-10-29-17/h4-5,12,15H,6-11,13-14H2,1-3H3,(H,21,25)