5-ethyl-6-oxidanylidene-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1H-pyrimidin-4-olate

Systemtic Name: 5-ethyl-6-oxidanylidene-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1H-pyrimidin-4-olate Openeye Name: 2-(2-anilino-2-oxo-ethyl)sulfanyl-5-ethyl-6-oxo-1H-pyrimidin-4-olate CAS Name: 2-[(2-anilino-2-oxoethyl)thio]-5-ethyl-6-oxo-1H-pyrimidin-4-olate IUPAC Name: 2-(2-anilino-2-oxoethyl)sulfanyl-5-ethyl-6-oxo-1H-pyrimidin-4-olate Traditional Name: 2-[(2-anilino-2-keto-ethyl)thio]-5-ethyl-6-keto-1H-pyrimidin-4-olate Formula: C14H14N3O3S- MolecularWeight: 304.34426

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(NC1=O)SCC(=O)NC2=CC=CC=C2)[O-]

Isomeric SMILES

CCC1=C(N=C(NC1=O)SCC(=O)NC2=CC=CC=C2)[O-]

InChI

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