2-[4-chloranyl-6-(diethylamino)pyrimidin-2-yl]sulfanyl-1-(4-ethanoylpiperazin-1-yl)ethanone

Systemtic Name: 2-[4-chloranyl-6-(diethylamino)pyrimidin-2-yl]sulfanyl-1-(4-ethanoylpiperazin-1-yl)ethanone Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-[4-chloro-6-(diethylamino)pyrimidin-2-yl]sulfanyl-ethanone CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[[4-chloro-6-(diethylamino)-2-pyrimidinyl]thio]ethanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-[4-chloro-6-(diethylamino)pyrimidin-2-yl]sulfanylethanone Traditional Name: 1-(4-acetylpiperazino)-2-[[4-chloro-6-(diethylamino)pyrimidin-2-yl]thio]ethanone Formula: C16H24ClN5O2S MolecularWeight: 385.91206

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=NC(=N1)SCC(=O)N2CCN(CC2)C(=O)C)Cl

Isomeric SMILES

CCN(CC)C1=CC(=NC(=N1)SCC(=O)N2CCN(CC2)C(=O)C)Cl

InChI

InChI=1S/C16H24ClN5O2S/c1-4-20(5-2)14-10-13(17)18-16(19-14)25-11-15(24)22-8-6-21(7-9-22)12(3)23/h10H,4-9,11H2,1-3H3