1,1-bis(oxidanylidene)-4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]thiolan-3-ol

Systemtic Name: 1,1-bis(oxidanylidene)-4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]thiolan-3-ol Openeye Name: 1,1-dioxo-4-[4-(2-pyridylmethyl)piperazin-1-yl]thiolan-3-ol CAS Name: 1,1-dioxo-4-[4-(2-pyridinylmethyl)-1-piperazinyl]-3-thiolanol IUPAC Name: 1,1-dioxo-4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]thiolan-3-ol Traditional Name: 1,1-diketo-4-[4-(2-pyridylmethyl)piperazino]thiolan-3-ol Formula: C14H21N3O3S MolecularWeight: 311.39984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=N2)C3CS(=O)(=O)CC3O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=N2)C3CS(=O)(=O)CC3O

InChI

InChI=1S/C14H21N3O3S/c18-14-11-21(19,20)10-13(14)17-7-5-16(6-8-17)9-12-3-1-2-4-15-12/h1-4,13-14,18H,5-11H2