2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C19H22N4O2S2 MolecularWeight: 402.53358

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)COC3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)COC3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C19H22N4O2S2/c24-17(22-8-10-23(11-9-22)19-20-6-1-7-21-19)14-25-16-4-2-15(3-5-16)18-26-12-13-27-18/h1-7,18H,8-14H2