5-nitro-6-prop-2-enylsulfanyl-pyrimidin-4-olate

Systemtic Name: 5-nitro-6-prop-2-enylsulfanyl-pyrimidin-4-olate Openeye Name: 6-allylsulfanyl-5-nitro-pyrimidin-4-olate CAS Name: 5-nitro-6-(prop-2-enylthio)-4-pyrimidinolate IUPAC Name: 5-nitro-6-prop-2-enylsulfanylpyrimidin-4-olate Traditional Name: 6-(allylthio)-5-nitro-pyrimidin-4-olate Formula: C7H6N3O3S- MolecularWeight: 212.20584

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC=NC(=C1[N+](=O)[O-])[O-]

Isomeric SMILES

C=CCSC1=NC=NC(=C1[N+](=O)[O-])[O-]

InChI

InChI=1S/C7H7N3O3S/c1-2-3-14-7-5(10(12)13)6(11)8-4-9-7/h2,4H,1,3H2,(H,8,9,11)/p-1