ethyl 6-[[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]carbonyloxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]carbonyloxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[1-(2-fluorophenyl)sulfonylpiperidine-4-carbonyl]oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[1-(2-fluorophenyl)sulfonyl-4-piperidinyl]-oxomethoxy]methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[1-(2-fluorophenyl)sulfonylpiperidine-4-carbonyl]oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[1-(2-fluorophenyl)sulfonylisonipecotoyl]oxymethyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H26FN3O7S MolecularWeight: 483.510443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H26FN3O7S/c1-3-31-20(27)18-13(2)23-21(28)24-16(18)12-32-19(26)14-8-10-25(11-9-14)33(29,30)17-7-5-4-6-15(17)22/h4-7,13-14H,3,8-12H2,1-2H3,(H2,23,24,28)