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

Systemtic Name: (2R)-2-[[5-[(4-methoxyphenyl)methyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]propanoate Openeye Name: (2R)-2-[[5-[(4-methoxyphenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]sulfanyl]propanoate CAS Name: (2R)-2-[[5-[(4-methoxyphenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]thio]propanoate IUPAC Name: (2R)-2-[[5-[(4-methoxyphenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]sulfanyl]propanoate Traditional Name: (2R)-2-[(4-keto-6-methyl-5-p-anisyl-1H-pyrimidin-2-yl)thio]propionate Formula: C16H17N2O4S- MolecularWeight: 333.38218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4S/c1-9-13(8-11-4-6-12(22-3)7-5-11)14(19)18-16(17-9)23-10(2)15(20)21/h4-7,10H,8H2,1-3H3,(H,20,21)(H,17,18,19)/p-1/t10-/m1/s1