ethyl (4S)-4-methyl-6-[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)carbonyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-methyl-6-[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)carbonyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-methyl-6-[(4-methyl-3-morpholinosulfonyl-benzoyl)oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-methyl-6-[[[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-oxomethoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-methyl-6-[(4-methyl-3-morpholin-4-ylsulfonylbenzoyl)oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-2-keto-4-methyl-6-[(4-methyl-3-morpholinosulfonyl-benzoyl)oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H27N3O8S MolecularWeight: 481.51938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C)COC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H27N3O8S/c1-4-31-20(26)18-14(3)22-21(27)23-16(18)12-32-19(25)15-6-5-13(2)17(11-15)33(28,29)24-7-9-30-10-8-24/h5-6,11,14H,4,7-10,12H2,1-3H3,(H2,22,23,27)/t14-/m0/s1