dimethyl 5-ethyl-5-(phenylcarbonyl)-2-sulfanylidene-pyrimidine-4,6-dicarboxylate

Systemtic Name: dimethyl 5-ethyl-5-(phenylcarbonyl)-2-sulfanylidene-pyrimidine-4,6-dicarboxylate Openeye Name: dimethyl 5-benzoyl-5-ethyl-2-thioxo-pyrimidine-4,6-dicarboxylate CAS Name: 5-benzoyl-5-ethyl-2-sulfanylidenepyrimidine-4,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-benzoyl-5-ethyl-2-sulfanylidenepyrimidine-4,6-dicarboxylate Traditional Name: 5-benzoyl-5-ethyl-2-thioxo-pyrimidine-4,6-dicarboxylic acid dimethyl ester Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=NC(=S)N=C1C(=O)OC)C(=O)OC)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCC1(C(=NC(=S)N=C1C(=O)OC)C(=O)OC)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H16N2O5S/c1-4-17(13(20)10-8-6-5-7-9-10)11(14(21)23-2)18-16(25)19-12(17)15(22)24-3/h5-9H,4H2,1-3H3