2-[2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanylpyrimidin-4-olate

Systemtic Name: 2-[2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanylpyrimidin-4-olate Openeye Name: 2-[2-[cyclohexyl(methyl)amino]-2-oxo-ethyl]sulfanylpyrimidin-4-olate CAS Name: 2-[[2-[cyclohexyl(methyl)amino]-2-oxoethyl]thio]-4-pyrimidinolate IUPAC Name: 2-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]sulfanylpyrimidin-4-olate Traditional Name: 2-[[2-[cyclohexyl(methyl)amino]-2-keto-ethyl]thio]pyrimidin-4-olate Formula: C13H18N3O2S- MolecularWeight: 280.36592

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)CSC2=NC=CC(=N2)[O-]

Isomeric SMILES

CN(C1CCCCC1)C(=O)CSC2=NC=CC(=N2)[O-]

InChI

InChI=1S/C13H19N3O2S/c1-16(10-5-3-2-4-6-10)12(18)9-19-13-14-8-7-11(17)15-13/h7-8,10H,2-6,9H2,1H3,(H,14,15,17)/p-1