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

Systemtic Name: ethyl 2-methylsulfanyl-6-oxidanylidene-1-[2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl]pyrimidine-5-carboxylate Openeye Name: ethyl 1-[2-(2-isopropylanilino)-2-oxo-ethyl]-2-methylsulfanyl-6-oxo-pyrimidine-5-carboxylate CAS Name: 2-(methylthio)-6-oxo-1-[2-oxo-2-(2-propan-2-ylanilino)ethyl]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-6-oxo-1-[2-oxo-2-(2-propan-2-ylanilino)ethyl]pyrimidine-5-carboxylate Traditional Name: 1-[2-(2-isopropylanilino)-2-keto-ethyl]-6-keto-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C19H23N3O4S MolecularWeight: 389.46862

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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)SC

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O4S/c1-5-26-18(25)14-10-20-19(27-4)22(17(14)24)11-16(23)21-15-9-7-6-8-13(15)12(2)3/h6-10,12H,5,11H2,1-4H3,(H,21,23)