2-[(2R)-1-(methylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-6-propyl-pyrimidin-4-olate

Systemtic Name: 2-[(2R)-1-(methylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-6-propyl-pyrimidin-4-olate Openeye Name: 2-[(1R)-1-methyl-2-(methylamino)-2-oxo-ethyl]sulfanyl-6-propyl-pyrimidin-4-olate CAS Name: 2-[[(2R)-1-(methylamino)-1-oxopropan-2-yl]thio]-6-propyl-4-pyrimidinolate IUPAC Name: 2-[(2R)-1-(methylamino)-1-oxopropan-2-yl]sulfanyl-6-propylpyrimidin-4-olate Traditional Name: 2-[[(1R)-2-keto-1-methyl-2-(methylamino)ethyl]thio]-6-propyl-pyrimidin-4-olate Formula: C11H16N3O2S- MolecularWeight: 254.32864

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC(=N1)SC(C)C(=O)NC)[O-]

Isomeric SMILES

CCCC1=CC(=NC(=N1)S[C@H](C)C(=O)NC)[O-]

InChI

InChI=1S/C11H17N3O2S/c1-4-5-8-6-9(15)14-11(13-8)17-7(2)10(16)12-3/h6-7H,4-5H2,1-3H3,(H,12,16)(H,13,14,15)/p-1/t7-/m1/s1