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

Systemtic Name: (3R)-1-(2,5-dimethoxyphenyl)-3-[(4-oxidanyl-6-oxidanylidene-5-propyl-1H-pyrimidin-2-yl)sulfanyl]pyrrolidine-2,5-dione Openeye Name: (3R)-1-(2,5-dimethoxyphenyl)-3-[(4-hydroxy-6-oxo-5-propyl-1H-pyrimidin-2-yl)sulfanyl]pyrrolidine-2,5-dione CAS Name: (3R)-1-(2,5-dimethoxyphenyl)-3-[(4-hydroxy-6-oxo-5-propyl-1H-pyrimidin-2-yl)thio]pyrrolidine-2,5-dione IUPAC Name: (3R)-1-(2,5-dimethoxyphenyl)-3-[(4-hydroxy-6-oxo-5-propyl-1H-pyrimidin-2-yl)sulfanyl]pyrrolidine-2,5-dione Traditional Name: (3R)-1-(2,5-dimethoxyphenyl)-3-[(4-hydroxy-6-keto-5-propyl-1H-pyrimidin-2-yl)thio]pyrrolidine-2,5-quinone Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C(NC1=O)SC2CC(=O)N(C2=O)C3=C(C=CC(=C3)OC)OC)O

Isomeric SMILES

CCCC1=C(N=C(NC1=O)S[C@@H]2CC(=O)N(C2=O)C3=C(C=CC(=C3)OC)OC)O

InChI

InChI=1S/C19H21N3O6S/c1-4-5-11-16(24)20-19(21-17(11)25)29-14-9-15(23)22(18(14)26)12-8-10(27-2)6-7-13(12)28-3/h6-8,14H,4-5,9H2,1-3H3,(H2,20,21,24,25)/t14-/m1/s1