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ethyl 2-[(5-nitro-6-oxidanylidene-1H-pyrimidin-4-yl)sulfanyl]ethanoate

ethyl 2-[(5-nitro-6-oxidanylidene-1H-pyrimidin-4-yl)sulfanyl]ethanoate

Systemtic Name:ethyl 2-[(5-nitro-6-oxidanylidene-1H-pyrimidin-4-yl)sulfanyl]ethanoate
Openeye Name:ethyl 2-[(5-nitro-6-oxo-1H-pyrimidin-4-yl)sulfanyl]acetate
CAS Name:2-[(5-nitro-6-oxo-1H-pyrimidin-4-yl)thio]acetic acid ethyl ester
IUPAC Name:ethyl 2-[(5-nitro-6-oxo-1H-pyrimidin-4-yl)sulfanyl]acetate
Traditional Name:2-[(6-keto-5-nitro-1H-pyrimidin-4-yl)thio]acetic acid ethyl ester
Formula: C8H9N3O5S
MolecularWeight: 259.23916
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C(=O)NC=N1)[N+](=O)[O-]


Isomeric SMILES

CCOC(=O)CSC1=C(C(=O)NC=N1)[N+](=O)[O-]


InChI

InChI=1S/C8H9N3O5S/c1-2-16-5(12)3-17-8-6(11(14)15)7(13)9-4-10-8/h4H,2-3H2,1H3,(H,9,10,13)


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