2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-5-methyl-3-(4-methylphenyl)-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-5-methyl-3-(4-methylphenyl)-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 2-(2-amino-2-oxo-ethyl)sulfanyl-5-methyl-6-oxo-3-(p-tolyl)pyrimidin-4-olate CAS Name: 2-[(2-amino-2-oxoethyl)thio]-5-methyl-3-(4-methylphenyl)-6-oxo-4-pyrimidinolate IUPAC Name: 2-(2-amino-2-oxoethyl)sulfanyl-5-methyl-3-(4-methylphenyl)-6-oxopyrimidin-4-olate Traditional Name: 2-[(2-amino-2-keto-ethyl)thio]-6-keto-5-methyl-3-(p-tolyl)pyrimidin-4-olate Formula: C14H14N3O3S- MolecularWeight: 304.34426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=O)N=C2SCC(=O)N)C)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=O)N=C2SCC(=O)N)C)[O-]

InChI

InChI=1S/C14H15N3O3S/c1-8-3-5-10(6-4-8)17-13(20)9(2)12(19)16-14(17)21-7-11(15)18/h3-6,20H,7H2,1-2H3,(H2,15,18)/p-1