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

Systemtic Name: 3-[(5-butyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-1-(5-chloranyl-2-methyl-phenyl)pyrrolidine-2,5-dione Openeye Name: 3-[(5-butyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-1-(5-chloro-2-methyl-phenyl)pyrrolidine-2,5-dione CAS Name: 3-[(5-butyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]-1-(5-chloro-2-methylphenyl)pyrrolidine-2,5-dione IUPAC Name: 3-[(5-butyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-1-(5-chloro-2-methylphenyl)pyrrolidine-2,5-dione Traditional Name: 3-[(5-butyl-4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]-1-(5-chloro-2-methyl-phenyl)pyrrolidine-2,5-quinone Formula: C19H20ClN3O4S MolecularWeight: 421.8978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=C(NC1=O)SC2CC(=O)N(C2=O)C3=C(C=CC(=C3)Cl)C)O

Isomeric SMILES

CCCCC1=C(N=C(NC1=O)SC2CC(=O)N(C2=O)C3=C(C=CC(=C3)Cl)C)O

InChI

InChI=1S/C19H20ClN3O4S/c1-3-4-5-12-16(25)21-19(22-17(12)26)28-14-9-15(24)23(18(14)27)13-8-11(20)7-6-10(13)2/h6-8,14H,3-5,9H2,1-2H3,(H2,21,22,25,26)