1-[(2S)-3-azido-2-oxidanyl-propyl]-5-methyl-2-methylsulfanyl-pyrimidin-4-one

Systemtic Name: 1-[(2S)-3-azido-2-oxidanyl-propyl]-5-methyl-2-methylsulfanyl-pyrimidin-4-one Openeye Name: 1-[(2S)-3-azido-2-hydroxy-propyl]-5-methyl-2-methylsulfanyl-pyrimidin-4-one CAS Name: 1-[(2S)-3-azido-2-hydroxypropyl]-5-methyl-2-(methylthio)-4-pyrimidinone IUPAC Name: 1-[(2S)-3-azido-2-hydroxypropyl]-5-methyl-2-methylsulfanylpyrimidin-4-one Traditional Name: 1-[(2S)-3-azido-2-hydroxy-propyl]-5-methyl-2-(methylthio)pyrimidin-4-one Formula: C9H13N5O2S MolecularWeight: 255.29682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=NC1=O)SC)CC(CN=[N+]=[N-])O

Isomeric SMILES

CC1=CN(C(=NC1=O)SC)C[C@@H](CN=[N+]=[N-])O

InChI

InChI=1S/C9H13N5O2S/c1-6-4-14(5-7(15)3-11-13-10)9(17-2)12-8(6)16/h4,7,15H,3,5H2,1-2H3/t7-/m1/s1