2-butylsulfanyl-3-methyl-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 2-butylsulfanyl-3-methyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 2-butylsulfanyl-3-methyl-6-oxo-pyrimidin-4-olate CAS Name: 2-(butylthio)-3-methyl-6-oxo-4-pyrimidinolate IUPAC Name: 2-butylsulfanyl-3-methyl-6-oxopyrimidin-4-olate Traditional Name: 2-(butylthio)-6-keto-3-methyl-pyrimidin-4-olate Formula: C9H13N2O2S- MolecularWeight: 213.27672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=O)C=C(N1C)[O-]

Isomeric SMILES

CCCCSC1=NC(=O)C=C(N1C)[O-]

InChI

InChI=1S/C9H14N2O2S/c1-3-4-5-14-9-10-7(12)6-8(13)11(9)2/h6,13H,3-5H2,1-2H3/p-1