methyl 2-(3-nitro-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)sulfanylethanoate

Systemtic Name: methyl 2-(3-nitro-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)sulfanylethanoate Openeye Name: methyl 2-(3-nitro-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(3-nitro-4-oxo-2-pyrido[1,2-a]pyrimidinyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(3-nitro-4-oxopyrido[1,2-a]pyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(4-keto-3-nitro-pyrido[1,2-a]pyrimidin-2-yl)thio]acetic acid methyl ester Formula: C11H9N3O5S MolecularWeight: 295.27126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=C(C(=O)N2C=CC=CC2=N1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CSC1=C(C(=O)N2C=CC=CC2=N1)[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O5S/c1-19-8(15)6-20-10-9(14(17)18)11(16)13-5-3-2-4-7(13)12-10/h2-5H,6H2,1H3