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

Systemtic Name: 2-[4-(1,3-dithian-2-yl)phenoxy]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[4-(1,3-dithian-2-yl)phenoxy]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[4-(1,3-dithian-2-yl)phenoxy]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[4-(1,3-dithian-2-yl)phenoxy]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[4-(1,3-dithian-2-yl)phenoxy]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C20H24N4O2S2 MolecularWeight: 416.56016

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC=C(C=C2)OCC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CSC(SC1)C2=CC=C(C=C2)OCC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H24N4O2S2/c25-18(23-9-11-24(12-10-23)20-21-7-1-8-22-20)15-26-17-5-3-16(4-6-17)19-27-13-2-14-28-19/h1,3-8,19H,2,9-15H2