2-[4-chloranyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[4-chloranyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanylethanoic acid Openeye Name: 2-[4-chloro-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanylacetic acid CAS Name: 2-[[4-chloro-6-(4-methyl-1-piperazinyl)-2-pyrimidinyl]thio]acetic acid IUPAC Name: 2-[4-chloro-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanylacetic acid Traditional Name: 2-[[4-chloro-6-(4-methylpiperazino)pyrimidin-2-yl]thio]acetic acid Formula: C11H15ClN4O2S MolecularWeight: 302.7804

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=NC(=N2)SCC(=O)O)Cl

Isomeric SMILES

CN1CCN(CC1)C2=CC(=NC(=N2)SCC(=O)O)Cl

InChI

InChI=1S/C11H15ClN4O2S/c1-15-2-4-16(5-3-15)9-6-8(12)13-11(14-9)19-7-10(17)18/h6H,2-5,7H2,1H3,(H,17,18)