2-(2-morpholin-4-ylethylsulfanyl)-6-oxidanylidene-5-propan-2-yl-1H-pyrimidin-4-olate

Systemtic Name: 2-(2-morpholin-4-ylethylsulfanyl)-6-oxidanylidene-5-propan-2-yl-1H-pyrimidin-4-olate Openeye Name: 5-isopropyl-2-(2-morpholinoethylsulfanyl)-6-oxo-1H-pyrimidin-4-olate CAS Name: 2-[2-(4-morpholinyl)ethylthio]-6-oxo-5-propan-2-yl-1H-pyrimidin-4-olate IUPAC Name: 2-(2-morpholin-4-ylethylsulfanyl)-6-oxo-5-propan-2-yl-1H-pyrimidin-4-olate Traditional Name: 5-isopropyl-6-keto-2-(2-morpholinoethylthio)-1H-pyrimidin-4-olate Formula: C13H20N3O3S- MolecularWeight: 298.3812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N=C(NC1=O)SCCN2CCOCC2)[O-]

Isomeric SMILES

CC(C)C1=C(N=C(NC1=O)SCCN2CCOCC2)[O-]

InChI

InChI=1S/C13H21N3O3S/c1-9(2)10-11(17)14-13(15-12(10)18)20-8-5-16-3-6-19-7-4-16/h9H,3-8H2,1-2H3,(H2,14,15,17,18)/p-1