5-[(5-ethanoyl-2-propan-2-yloxy-phenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-olate

Systemtic Name: 5-[(5-ethanoyl-2-propan-2-yloxy-phenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-olate Openeye Name: 5-[(5-acetyl-2-isopropoxy-phenyl)methyl]-4-oxo-2-thioxo-1H-pyrimidin-6-olate CAS Name: 5-[(5-acetyl-2-propan-2-yloxyphenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidin-6-olate IUPAC Name: 5-[(5-acetyl-2-propan-2-yloxyphenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidin-6-olate Traditional Name: 5-(5-acetyl-2-isopropoxy-benzyl)-4-keto-2-thioxo-1H-pyrimidin-6-olate Formula: C16H17N2O4S- MolecularWeight: 333.38218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(=O)C)CC2=C(NC(=S)NC2=O)[O-]

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(=O)C)CC2=C(NC(=S)NC2=O)[O-]

InChI

InChI=1S/C16H18N2O4S/c1-8(2)22-13-5-4-10(9(3)19)6-11(13)7-12-14(20)17-16(23)18-15(12)21/h4-6,8H,7H2,1-3H3,(H3,17,18,20,21,23)/p-1