2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-[4-(2-pyridylmethyl)piperazin-1-yl]-1-[4-(2-thienylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-[4-(2-pyridinylmethyl)-1-piperazinyl]-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-[4-(2-pyridylmethyl)piperazino]-1-[4-(2-thienylsulfonyl)piperazino]ethanone Formula: C20H27N5O3S2 MolecularWeight: 449.59008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=N2)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=N2)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H27N5O3S2/c26-19(17-23-9-7-22(8-10-23)16-18-4-1-2-6-21-18)24-11-13-25(14-12-24)30(27,28)20-5-3-15-29-20/h1-6,15H,7-14,16-17H2