3-[(5-ethyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-1-(4-phenoxyphenyl)pyrrolidine-2,5-dione

Systemtic Name: 3-[(5-ethyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-1-(4-phenoxyphenyl)pyrrolidine-2,5-dione Openeye Name: 3-[(5-ethyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-1-(4-phenoxyphenyl)pyrrolidine-2,5-dione CAS Name: 3-[(5-ethyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]-1-(4-phenoxyphenyl)pyrrolidine-2,5-dione IUPAC Name: 3-[(5-ethyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-1-(4-phenoxyphenyl)pyrrolidine-2,5-dione Traditional Name: 3-[(5-ethyl-4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]-1-(4-phenoxyphenyl)pyrrolidine-2,5-quinone Formula: C22H19N3O5S MolecularWeight: 437.46836

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(NC1=O)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4)O

Isomeric SMILES

CCC1=C(N=C(NC1=O)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4)O

InChI

InChI=1S/C22H19N3O5S/c1-2-16-19(27)23-22(24-20(16)28)31-17-12-18(26)25(21(17)29)13-8-10-15(11-9-13)30-14-6-4-3-5-7-14/h3-11,17H,2,12H2,1H3,(H2,23,24,27,28)