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

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[(5-methyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]pyrrolidine-2,5-dione Openeye Name: 1-(3,5-dimethylphenyl)-3-[(4-hydroxy-5-methyl-6-oxo-1H-pyrimidin-2-yl)sulfanyl]pyrrolidine-2,5-dione CAS Name: 1-(3,5-dimethylphenyl)-3-[(4-hydroxy-5-methyl-6-oxo-1H-pyrimidin-2-yl)thio]pyrrolidine-2,5-dione IUPAC Name: 1-(3,5-dimethylphenyl)-3-[(4-hydroxy-5-methyl-6-oxo-1H-pyrimidin-2-yl)sulfanyl]pyrrolidine-2,5-dione Traditional Name: 1-(3,5-dimethylphenyl)-3-[(4-hydroxy-6-keto-5-methyl-1H-pyrimidin-2-yl)thio]pyrrolidine-2,5-quinone Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)CC(C2=O)SC3=NC(=C(C(=O)N3)C)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)CC(C2=O)SC3=NC(=C(C(=O)N3)C)O)C

InChI

InChI=1S/C17H17N3O4S/c1-8-4-9(2)6-11(5-8)20-13(21)7-12(16(20)24)25-17-18-14(22)10(3)15(23)19-17/h4-6,12H,7H2,1-3H3,(H2,18,19,22,23)