2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-1-(4-ethanoylpiperazin-1-yl)ethanone

Systemtic Name: 2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-1-(4-ethanoylpiperazin-1-yl)ethanone Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-ethanone CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[(4-amino-6-methyl-2-pyrimidinyl)thio]ethanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-(4-amino-6-methylpyrimidin-2-yl)sulfanylethanone Traditional Name: 1-(4-acetylpiperazino)-2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]ethanone Formula: C13H19N5O2S MolecularWeight: 309.38726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2CCN(CC2)C(=O)C)N

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2CCN(CC2)C(=O)C)N

InChI

InChI=1S/C13H19N5O2S/c1-9-7-11(14)16-13(15-9)21-8-12(20)18-5-3-17(4-6-18)10(2)19/h7H,3-6,8H2,1-2H3,(H2,14,15,16)