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

Systemtic Name: ethyl 2-oxidanylidene-6-[[1-(phenylsulfonyl)piperidin-2-yl]carbonyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[1-(benzenesulfonyl)piperidine-2-carbonyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[1-(benzenesulfonyl)-2-piperidinyl]-oxomethoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[1-(benzenesulfonyl)piperidine-2-carbonyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(1-besylpipecoloyl)oxymethyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H25N3O7S MolecularWeight: 451.4934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)C2CCCCN2S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)C2CCCCN2S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H25N3O7S/c1-2-29-18(24)15-12-21-20(26)22-16(15)13-30-19(25)17-10-6-7-11-23(17)31(27,28)14-8-4-3-5-9-14/h3-5,8-9,17H,2,6-7,10-13H2,1H3,(H2,21,22,26)