ethyl 6-oxidanylidene-1-[2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl]-2-phenethylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-oxidanylidene-1-[2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl]-2-phenethylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 1-[2-(2-isopropylanilino)-2-oxo-ethyl]-6-oxo-2-phenethylsulfanyl-pyrimidine-5-carboxylate CAS Name: 6-oxo-1-[2-oxo-2-(2-propan-2-ylanilino)ethyl]-2-(phenethylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-oxo-1-[2-oxo-2-(2-propan-2-ylanilino)ethyl]-2-phenethylsulfanylpyrimidine-5-carboxylate Traditional Name: 1-[2-(2-isopropylanilino)-2-keto-ethyl]-6-keto-2-(phenethylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=CC=CC=C2C(C)C)SCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=CC=CC=C2C(C)C)SCCC3=CC=CC=C3

InChI

InChI=1S/C26H29N3O4S/c1-4-33-25(32)21-16-27-26(34-15-14-19-10-6-5-7-11-19)29(24(21)31)17-23(30)28-22-13-9-8-12-20(22)18(2)3/h5-13,16,18H,4,14-15,17H2,1-3H3,(H,28,30)