2-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]sulfanyl-5,6-dimethyl-pyrimidin-4-olate

Systemtic Name: 2-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]sulfanyl-5,6-dimethyl-pyrimidin-4-olate Openeye Name: 2-[2-(cyclopentylamino)-2-oxo-ethyl]sulfanyl-5,6-dimethyl-pyrimidin-4-olate CAS Name: 2-[[2-(cyclopentylamino)-2-oxoethyl]thio]-5,6-dimethyl-4-pyrimidinolate IUPAC Name: 2-[2-(cyclopentylamino)-2-oxoethyl]sulfanyl-5,6-dimethylpyrimidin-4-olate Traditional Name: 2-[[2-(cyclopentylamino)-2-keto-ethyl]thio]-5,6-dimethyl-pyrimidin-4-olate Formula: C13H18N3O2S- MolecularWeight: 280.36592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1[O-])SCC(=O)NC2CCCC2)C

Isomeric SMILES

CC1=C(N=C(N=C1[O-])SCC(=O)NC2CCCC2)C

InChI

InChI=1S/C13H19N3O2S/c1-8-9(2)14-13(16-12(8)18)19-7-11(17)15-10-5-3-4-6-10/h10H,3-7H2,1-2H3,(H,15,17)(H,14,16,18)/p-1