1-[4-(4-ethanoylphenyl)piperazin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(4-ethanoylphenyl)piperazin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanone Openeye Name: 1-[4-(4-acetylphenyl)piperazin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanone CAS Name: 1-[4-(4-acetylphenyl)-1-piperazinyl]-2-(4-thieno[2,3-d]pyrimidinylthio)ethanone IUPAC Name: 1-[4-(4-acetylphenyl)piperazin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanone Traditional Name: 1-[4-(4-acetylphenyl)piperazino]-2-(thieno[2,3-d]pyrimidin-4-ylthio)ethanone Formula: C20H20N4O2S2 MolecularWeight: 412.5284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)CSC3=NC=NC4=C3C=CS4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)CSC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C20H20N4O2S2/c1-14(25)15-2-4-16(5-3-15)23-7-9-24(10-8-23)18(26)12-28-20-17-6-11-27-19(17)21-13-22-20/h2-6,11,13H,7-10,12H2,1H3