(2R)-2-(6-methylpyrimidin-4-yl)sulfanyl-2-phenyl-ethanoic acid

Systemtic Name: (2R)-2-(6-methylpyrimidin-4-yl)sulfanyl-2-phenyl-ethanoic acid Openeye Name: (2R)-2-(6-methylpyrimidin-4-yl)sulfanyl-2-phenyl-acetic acid CAS Name: (2R)-2-[(6-methyl-4-pyrimidinyl)thio]-2-phenylacetic acid IUPAC Name: (2R)-2-(6-methylpyrimidin-4-yl)sulfanyl-2-phenylacetic acid Traditional Name: (2R)-2-[(6-methylpyrimidin-4-yl)thio]-2-phenyl-acetic acid Formula: C13H12N2O2S MolecularWeight: 260.31158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)SC(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=CC(=NC=N1)S[C@H](C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C13H12N2O2S/c1-9-7-11(15-8-14-9)18-12(13(16)17)10-5-3-2-4-6-10/h2-8,12H,1H3,(H,16,17)/t12-/m1/s1