methyl 2-[4-oxidanylidene-2-[2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl]sulfanyl-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[4-oxidanylidene-2-[2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl]sulfanyl-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[2-(2-benzoylhydrazino)-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[2-(benzoylhydrazo)-2-oxoethyl]thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-(2-benzoylhydrazinyl)-2-oxoethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[[2-(N'-benzoylhydrazino)-2-keto-ethyl]thio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C16H16N4O5S MolecularWeight: 376.38704

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)SCC(=O)NNC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)SCC(=O)NNC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H16N4O5S/c1-25-14(23)8-11-7-12(21)18-16(17-11)26-9-13(22)19-20-15(24)10-5-3-2-4-6-10/h2-7H,8-9H2,1H3,(H,19,22)(H,20,24)(H,17,18,21)