5-ethyl-2-[2-[(2R)-2-ethylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate

Systemtic Name: 5-ethyl-2-[2-[(2R)-2-ethylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate Openeye Name: 5-ethyl-2-[2-[(2R)-2-ethyl-1-piperidyl]-2-oxo-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate CAS Name: 5-ethyl-2-[[2-[(2R)-2-ethyl-1-piperidinyl]-2-oxoethyl]thio]-6-methyl-4-pyrimidinolate IUPAC Name: 5-ethyl-2-[2-[(2R)-2-ethylpiperidin-1-yl]-2-oxoethyl]sulfanyl-6-methylpyrimidin-4-olate Traditional Name: 5-ethyl-2-[[2-[(2R)-2-ethylpiperidino]-2-keto-ethyl]thio]-6-methyl-pyrimidin-4-olate Formula: C16H24N3O2S- MolecularWeight: 322.44566

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CSC2=NC(=C(C(=N2)[O-])CC)C

Isomeric SMILES

CC[C@@H]1CCCCN1C(=O)CSC2=NC(=C(C(=N2)[O-])CC)C

InChI

InChI=1S/C16H25N3O2S/c1-4-12-8-6-7-9-19(12)14(20)10-22-16-17-11(3)13(5-2)15(21)18-16/h12H,4-10H2,1-3H3,(H,17,18,21)/p-1/t12-/m1/s1