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

Systemtic Name: ethyl 2-oxidanylidene-6-[[1-(phenylsulfonyl)piperidin-4-yl]carbonyloxymethyl]-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[1-(benzenesulfonyl)piperidine-4-carbonyl]oxymethyl]-2-oxo-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[1-(benzenesulfonyl)-4-piperidinyl]-oxomethoxy]methyl]-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[1-(benzenesulfonyl)piperidine-4-carbonyl]oxymethyl]-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(1-besylisonipecotoyl)oxymethyl]-2-keto-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C24H27N3O7S2 MolecularWeight: 533.61708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CS2)COC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CS2)COC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O7S2/c1-2-33-23(29)20-18(25-24(30)26-21(20)19-9-6-14-35-19)15-34-22(28)16-10-12-27(13-11-16)36(31,32)17-7-4-3-5-8-17/h3-9,14,16,21H,2,10-13,15H2,1H3,(H2,25,26,30)