(2R)-2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]butanoate

Systemtic Name: (2R)-2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]butanoate Openeye Name: (2R)-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]butanoate CAS Name: (2R)-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]butanoate IUPAC Name: (2R)-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]butanoate Traditional Name: (2R)-2-[(4-keto-6-phenyl-1H-pyrimidin-2-yl)thio]butyrate Formula: C14H13N2O3S- MolecularWeight: 289.32962

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])SC1=NC(=O)C=C(N1)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](C(=O)[O-])SC1=NC(=O)C=C(N1)C2=CC=CC=C2

InChI

InChI=1S/C14H14N2O3S/c1-2-11(13(18)19)20-14-15-10(8-12(17)16-14)9-6-4-3-5-7-9/h3-8,11H,2H2,1H3,(H,18,19)(H,15,16,17)/p-1/t11-/m1/s1