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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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