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

Systemtic Name: ethyl 2-oxidanylidene-6-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-oxo-6-[[1-(2-thienylsulfonyl)piperidine-4-carbonyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 2-oxo-6-[[oxo-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methoxy]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-oxo-6-[(1-thiophen-2-ylsulfonylpiperidine-4-carbonyl)oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-[[1-(2-thienylsulfonyl)isonipecotoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H23N3O7S2 MolecularWeight: 457.52112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H23N3O7S2/c1-2-27-17(23)13-10-19-18(24)20-14(13)11-28-16(22)12-5-7-21(8-6-12)30(25,26)15-4-3-9-29-15/h3-4,9,12H,2,5-8,10-11H2,1H3,(H2,19,20,24)