ethyl 1-[2-(diphenylamino)-2-oxidanylidene-ethyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-[2-(diphenylamino)-2-oxidanylidene-ethyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 2-methylsulfanyl-6-oxo-1-[2-oxo-2-(N-phenylanilino)ethyl]pyrimidine-5-carboxylate CAS Name: 2-(methylthio)-6-oxo-1-[2-oxo-2-(N-phenylanilino)ethyl]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-6-oxo-1-[2-oxo-2-(N-phenylanilino)ethyl]pyrimidine-5-carboxylate Traditional Name: 6-keto-1-[2-keto-2-(N-phenylanilino)ethyl]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O4S/c1-3-29-21(28)18-14-23-22(30-2)24(20(18)27)15-19(26)25(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-14H,3,15H2,1-2H3