ethyl 4-azanyl-2-[2-oxidanylidene-2-[2-oxidanylidene-2-(2-phenylethanoylamino)ethoxy]ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-oxidanylidene-2-[2-oxidanylidene-2-(2-phenylethanoylamino)ethoxy]ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-oxo-2-[2-oxo-2-[(2-phenylacetyl)amino]ethoxy]ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-oxo-2-[2-oxo-2-[(1-oxo-2-phenylethyl)amino]ethoxy]ethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-oxo-2-[2-oxo-2-[(2-phenylacetyl)amino]ethoxy]ethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-keto-2-[2-keto-2-[(2-phenylacetyl)amino]ethoxy]ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C19H20N4O6S MolecularWeight: 432.4503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)OCC(=O)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)OCC(=O)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C19H20N4O6S/c1-2-28-18(27)13-9-21-19(23-17(13)20)30-11-16(26)29-10-15(25)22-14(24)8-12-6-4-3-5-7-12/h3-7,9H,2,8,10-11H2,1H3,(H2,20,21,23)(H,22,24,25)