3-(2-methylphenyl)-2-(2-methylpropylsulfanyl)-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 3-(2-methylphenyl)-2-(2-methylpropylsulfanyl)-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 2-isobutylsulfanyl-3-(o-tolyl)-6-oxo-pyrimidin-4-olate CAS Name: 3-(2-methylphenyl)-2-(2-methylpropylthio)-6-oxo-4-pyrimidinolate IUPAC Name: 3-(2-methylphenyl)-2-(2-methylpropylsulfanyl)-6-oxopyrimidin-4-olate Traditional Name: 2-(isobutylthio)-6-keto-3-(o-tolyl)pyrimidin-4-olate Formula: C15H17N2O2S- MolecularWeight: 289.37268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=O)N=C2SCC(C)C)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=O)N=C2SCC(C)C)[O-]

InChI

InChI=1S/C15H18N2O2S/c1-10(2)9-20-15-16-13(18)8-14(19)17(15)12-7-5-4-6-11(12)3/h4-8,10,19H,9H2,1-3H3/p-1