ethyl 6-oxidanylidene-1-[2-oxidanylidene-2-(1-phenylethylamino)ethyl]-2-phenethylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-oxidanylidene-1-[2-oxidanylidene-2-(1-phenylethylamino)ethyl]-2-phenethylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 6-oxo-1-[2-oxo-2-(1-phenylethylamino)ethyl]-2-phenethylsulfanyl-pyrimidine-5-carboxylate CAS Name: 6-oxo-1-[2-oxo-2-(1-phenylethylamino)ethyl]-2-(phenethylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-oxo-1-[2-oxo-2-(1-phenylethylamino)ethyl]-2-phenethylsulfanylpyrimidine-5-carboxylate Traditional Name: 6-keto-1-[2-keto-2-(1-phenylethylamino)ethyl]-2-(phenethylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC(C)C2=CC=CC=C2)SCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC(C)C2=CC=CC=C2)SCCC3=CC=CC=C3

InChI

InChI=1S/C25H27N3O4S/c1-3-32-24(31)21-16-26-25(33-15-14-19-10-6-4-7-11-19)28(23(21)30)17-22(29)27-18(2)20-12-8-5-9-13-20/h4-13,16,18H,3,14-15,17H2,1-2H3,(H,27,29)