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

Systemtic Name: 2-[4-chloranyl-6-(diethylamino)pyrimidin-2-yl]sulfanylethanoic acid Openeye Name: 2-[4-chloro-6-(diethylamino)pyrimidin-2-yl]sulfanylacetic acid CAS Name: 2-[[4-chloro-6-(diethylamino)-2-pyrimidinyl]thio]acetic acid IUPAC Name: 2-[4-chloro-6-(diethylamino)pyrimidin-2-yl]sulfanylacetic acid Traditional Name: 2-[[4-chloro-6-(diethylamino)pyrimidin-2-yl]thio]acetic acid Formula: C10H14ClN3O2S MolecularWeight: 275.75506

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=NC(=N1)SCC(=O)O)Cl

Isomeric SMILES

CCN(CC)C1=CC(=NC(=N1)SCC(=O)O)Cl

InChI

InChI=1S/C10H14ClN3O2S/c1-3-14(4-2)8-5-7(11)12-10(13-8)17-6-9(15)16/h5H,3-4,6H2,1-2H3,(H,15,16)