ethyl (4R)-6-[5-[(3S)-1,2-dithiolan-3-yl]pentanoyloxymethyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4R)-6-[5-[(3S)-1,2-dithiolan-3-yl]pentanoyloxymethyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-6-[5-[(3S)-dithiolan-3-yl]pentanoyloxymethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-[[5-[(3S)-3-dithiolanyl]-1-oxopentoxy]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-6-[5-[(3S)-dithiolan-3-yl]pentanoyloxymethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-6-[5-[(3S)-dithiolan-3-yl]pentanoyloxymethyl]-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H28N2O5S2 MolecularWeight: 416.55532

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)CCCCC2CCSS2)C(=O)OCC

Isomeric SMILES

CC[C@@H]1C(=C(NC(=O)N1)COC(=O)CCCC[C@H]2CCSS2)C(=O)OCC

InChI

InChI=1S/C18H28N2O5S2/c1-3-13-16(17(22)24-4-2)14(20-18(23)19-13)11-25-15(21)8-6-5-7-12-9-10-26-27-12/h12-13H,3-11H2,1-2H3,(H2,19,20,23)/t12-,13+/m0/s1