2-(2-butylsulfanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethanoate

Systemtic Name: 2-(2-butylsulfanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethanoate Openeye Name: 2-(2-butylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)acetate CAS Name: 2-[2-(butylthio)-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetate IUPAC Name: 2-(2-butylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)acetate Traditional Name: 2-[2-(butylthio)-4-keto-6-methyl-1H-pyrimidin-5-yl]acetate Formula: C11H15N2O3S- MolecularWeight: 255.3134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=O)C(=C(N1)C)CC(=O)[O-]

Isomeric SMILES

CCCCSC1=NC(=O)C(=C(N1)C)CC(=O)[O-]

InChI

InChI=1S/C11H16N2O3S/c1-3-4-5-17-11-12-7(2)8(6-9(14)15)10(16)13-11/h3-6H2,1-2H3,(H,14,15)(H,12,13,16)/p-1