(2R)-2-[[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]sulfanyl]propanoate

Systemtic Name: (2R)-2-[[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]sulfanyl]propanoate Openeye Name: (2R)-2-[(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]propanoate CAS Name: (2R)-2-[[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]thio]propanoate IUPAC Name: (2R)-2-[(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]propanoate Traditional Name: (2R)-2-[(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)thio]propionate Formula: C15H15N2O3S- MolecularWeight: 303.3562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC(C)C(=O)[O-])CC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=O)N=C(N1)S[C@H](C)C(=O)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C15H16N2O3S/c1-9-12(8-11-6-4-3-5-7-11)13(18)17-15(16-9)21-10(2)14(19)20/h3-7,10H,8H2,1-2H3,(H,19,20)(H,16,17,18)/p-1/t10-/m1/s1