ethyl 1-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 1-[2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl]-2-methylsulfanyl-6-oxo-pyrimidine-5-carboxylate CAS Name: 1-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-2-(methylthio)-6-oxo-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-2-methylsulfanyl-6-oxopyrimidine-5-carboxylate Traditional Name: 1-[2-(2-ethyl-6-methyl-anilino)-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:

CCC1=CC=CC(=C1NC(=O)CN2C(=O)C(=CN=C2SC)C(=O)OCC)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CN2C(=O)C(=CN=C2SC)C(=O)OCC)C

InChI

InChI=1S/C19H23N3O4S/c1-5-13-9-7-8-12(3)16(13)21-15(23)11-22-17(24)14(18(25)26-6-2)10-20-19(22)27-4/h7-10H,5-6,11H2,1-4H3,(H,21,23)