2-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-6-propyl-pyrimidin-4-olate

Systemtic Name: 2-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-6-propyl-pyrimidin-4-olate Openeye Name: 2-[2-oxo-2-(thiazol-2-ylamino)ethyl]sulfanyl-6-propyl-pyrimidin-4-olate CAS Name: 2-[[2-oxo-2-(2-thiazolylamino)ethyl]thio]-6-propyl-4-pyrimidinolate IUPAC Name: 2-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-6-propylpyrimidin-4-olate Traditional Name: 2-[[2-keto-2-(thiazol-2-ylamino)ethyl]thio]-6-propyl-pyrimidin-4-olate Formula: C12H13N4O2S2- MolecularWeight: 309.38722

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC(=N1)SCC(=O)NC2=NC=CS2)[O-]

Isomeric SMILES

CCCC1=CC(=NC(=N1)SCC(=O)NC2=NC=CS2)[O-]

InChI

InChI=1S/C12H14N4O2S2/c1-2-3-8-6-9(17)15-12(14-8)20-7-10(18)16-11-13-4-5-19-11/h4-6H,2-3,7H2,1H3,(H,13,16,18)(H,14,15,17)/p-1