(2S)-2-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)sulfanyl-2-phenyl-ethanoic acid

Systemtic Name: (2S)-2-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)sulfanyl-2-phenyl-ethanoic acid Openeye Name: (2S)-2-(2-isopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-2-phenyl-acetic acid CAS Name: (2S)-2-[(6-methyl-2-propan-2-yl-4-pyrimidinyl)thio]-2-phenylacetic acid IUPAC Name: (2S)-2-(6-methyl-2-propan-2-ylpyrimidin-4-yl)sulfanyl-2-phenylacetic acid Traditional Name: (2S)-2-[(2-isopropyl-6-methyl-pyrimidin-4-yl)thio]-2-phenyl-acetic acid Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O2S/c1-10(2)15-17-11(3)9-13(18-15)21-14(16(19)20)12-7-5-4-6-8-12/h4-10,14H,1-3H3,(H,19,20)/t14-/m0/s1