ethyl 4-azanyl-2-[2-oxidanylidene-2-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethoxy]ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-oxidanylidene-2-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethoxy]ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-oxo-2-[2-oxo-2-(1H-pyrrol-2-yl)ethoxy]ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-oxo-2-[2-oxo-2-(1H-pyrrol-2-yl)ethoxy]ethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-oxo-2-[2-oxo-2-(1H-pyrrol-2-yl)ethoxy]ethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-keto-2-[2-keto-2-(1H-pyrrol-2-yl)ethoxy]ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C15H16N4O5S MolecularWeight: 364.37634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)OCC(=O)C2=CC=CN2

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)OCC(=O)C2=CC=CN2

InChI

InChI=1S/C15H16N4O5S/c1-2-23-14(22)9-6-18-15(19-13(9)16)25-8-12(21)24-7-11(20)10-4-3-5-17-10/h3-6,17H,2,7-8H2,1H3,(H2,16,18,19)