5-pyrimidin-2-ylsulfanylpentanoate

Systemtic Name: 5-pyrimidin-2-ylsulfanylpentanoate Openeye Name: 5-pyrimidin-2-ylsulfanylpentanoate CAS Name: 5-(2-pyrimidinylthio)pentanoate IUPAC Name: 5-pyrimidin-2-ylsulfanylpentanoate Traditional Name: 5-(2-pyrimidylthio)valerate Formula: C9H11N2O2S- MolecularWeight: 211.26084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCCCCC(=O)[O-]

Isomeric SMILES

C1=CN=C(N=C1)SCCCCC(=O)[O-]

InChI

InChI=1S/C9H12N2O2S/c12-8(13)4-1-2-7-14-9-10-5-3-6-11-9/h3,5-6H,1-2,4,7H2,(H,12,13)/p-1