1-(azepan-1-yl)-2-[4-[4-oxidanyl-1,1-bis(oxidanylidene)thiolan-3-yl]piperazin-1-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[4-[4-oxidanyl-1,1-bis(oxidanylidene)thiolan-3-yl]piperazin-1-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[4-(4-hydroxy-1,1-dioxo-thiolan-3-yl)piperazin-1-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[4-(4-hydroxy-1,1-dioxo-3-thiolanyl)-1-piperazinyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[4-(4-hydroxy-1,1-dioxothiolan-3-yl)piperazin-1-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[4-(4-hydroxy-1,1-diketo-thiolan-3-yl)piperazino]ethanone Formula: C16H29N3O4S MolecularWeight: 359.48416

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2CCN(CC2)C3CS(=O)(=O)CC3O

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2CCN(CC2)C3CS(=O)(=O)CC3O

InChI

InChI=1S/C16H29N3O4S/c20-15-13-24(22,23)12-14(15)18-9-7-17(8-10-18)11-16(21)19-5-3-1-2-4-6-19/h14-15,20H,1-13H2