1-[6-(2-methylprop-2-enoyloxy)hexyl]-4-oxidanylidene-2-sulfanylidene-pyrimidine-5-carboxylate

Systemtic Name: 1-[6-(2-methylprop-2-enoyloxy)hexyl]-4-oxidanylidene-2-sulfanylidene-pyrimidine-5-carboxylate Openeye Name: 1-[6-(2-methylprop-2-enoyloxy)hexyl]-4-oxo-2-thioxo-pyrimidine-5-carboxylate CAS Name: 1-[6-(2-methyl-1-oxoprop-2-enoxy)hexyl]-4-oxo-2-sulfanylidene-5-pyrimidinecarboxylate IUPAC Name: 1-[6-(2-methylprop-2-enoyloxy)hexyl]-4-oxo-2-sulfanylidenepyrimidine-5-carboxylate Traditional Name: 4-keto-1-(6-methacryloyloxyhexyl)-2-thioxo-pyrimidine-5-carboxylate Formula: C15H19N2O5S- MolecularWeight: 339.38676

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OCCCCCCN1C=C(C(=O)NC1=S)C(=O)[O-]

Isomeric SMILES

CC(=C)C(=O)OCCCCCCN1C=C(C(=O)NC1=S)C(=O)[O-]

InChI

InChI=1S/C15H20N2O5S/c1-10(2)14(21)22-8-6-4-3-5-7-17-9-11(13(19)20)12(18)16-15(17)23/h9H,1,3-8H2,2H3,(H,19,20)(H,16,18,23)/p-1