2-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate Openeye Name: 2-[2-(cyclopentylamino)-2-oxo-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate CAS Name: 2-[[2-(cyclopentylamino)-2-oxoethyl]thio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[2-(cyclopentylamino)-2-oxoethyl]sulfanyl-6-methylpyrimidin-4-olate Traditional Name: 2-[[2-(cyclopentylamino)-2-keto-ethyl]thio]-6-methyl-pyrimidin-4-olate Formula: C12H16N3O2S- MolecularWeight: 266.33934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2CCCC2)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2CCCC2)[O-]

InChI

InChI=1S/C12H17N3O2S/c1-8-6-10(16)15-12(13-8)18-7-11(17)14-9-4-2-3-5-9/h6,9H,2-5,7H2,1H3,(H,14,17)(H,13,15,16)/p-1