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

Systemtic Name: 4-oxidanylidene-5-[(4-propan-2-yloxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-6-olate Openeye Name: 5-[(4-isopropoxyphenyl)methyl]-4-oxo-2-thioxo-1H-pyrimidin-6-olate CAS Name: 4-oxo-5-[(4-propan-2-yloxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-6-olate IUPAC Name: 4-oxo-5-[(4-propan-2-yloxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-6-olate Traditional Name: 5-(4-isopropoxybenzyl)-4-keto-2-thioxo-1H-pyrimidin-6-olate Formula: C14H15N2O3S- MolecularWeight: 291.3455

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O3S/c1-8(2)19-10-5-3-9(4-6-10)7-11-12(17)15-14(20)16-13(11)18/h3-6,8H,7H2,1-2H3,(H3,15,16,17,18,20)/p-1