(2S)-2-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methylsulfanyl]propanoate

Systemtic Name: (2S)-2-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methylsulfanyl]propanoate Openeye Name: (2S)-2-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methylsulfanyl]propanoate CAS Name: (2S)-2-[(5,7-dimethyl-2-imidazo[1,2-a]pyrimidinyl)methylthio]propanoate IUPAC Name: (2S)-2-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methylsulfanyl]propanoate Traditional Name: (2S)-2-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methylthio]propionate Formula: C12H14N3O2S- MolecularWeight: 264.32346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=NC(=CN12)CSC(C)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=NC2=NC(=CN12)CS[C@@H](C)C(=O)[O-])C

InChI

InChI=1S/C12H15N3O2S/c1-7-4-8(2)15-5-10(14-12(15)13-7)6-18-9(3)11(16)17/h4-5,9H,6H2,1-3H3,(H,16,17)/p-1/t9-/m0/s1