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

Systemtic Name: 1-(2,4-dichlorophenyl)-3-[(4-oxidanyl-6-oxidanylidene-5-prop-2-enyl-1H-pyrimidin-2-yl)sulfanyl]pyrrolidine-2,5-dione Openeye Name: 3-[(5-allyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-1-(2,4-dichlorophenyl)pyrrolidine-2,5-dione CAS Name: 1-(2,4-dichlorophenyl)-3-[(4-hydroxy-6-oxo-5-prop-2-enyl-1H-pyrimidin-2-yl)thio]pyrrolidine-2,5-dione IUPAC Name: 1-(2,4-dichlorophenyl)-3-[(4-hydroxy-6-oxo-5-prop-2-enyl-1H-pyrimidin-2-yl)sulfanyl]pyrrolidine-2,5-dione Traditional Name: 3-[(5-allyl-4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]-1-(2,4-dichlorophenyl)pyrrolidine-2,5-quinone Formula: C17H13Cl2N3O4S MolecularWeight: 426.27382

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(N=C(NC1=O)SC2CC(=O)N(C2=O)C3=C(C=C(C=C3)Cl)Cl)O

Isomeric SMILES

C=CCC1=C(N=C(NC1=O)SC2CC(=O)N(C2=O)C3=C(C=C(C=C3)Cl)Cl)O

InChI

InChI=1S/C17H13Cl2N3O4S/c1-2-3-9-14(24)20-17(21-15(9)25)27-12-7-13(23)22(16(12)26)11-5-4-8(18)6-10(11)19/h2,4-6,12H,1,3,7H2,(H2,20,21,24,25)