ethyl 4-azanyl-2-[1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[1-methyl-2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-keto-1-methyl-2-(2,4,5-trimethylphenyl)ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SC(C)C(=O)C2=CC(=C(C=C2C)C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SC(C)C(=O)C2=CC(=C(C=C2C)C)C

InChI

InChI=1S/C19H23N3O3S/c1-6-25-18(24)15-9-21-19(22-17(15)20)26-13(5)16(23)14-8-11(3)10(2)7-12(14)4/h7-9,13H,6H2,1-5H3,(H2,20,21,22)