1-(4-chloranyl-2-fluoranyl-phenyl)-2-cyclohexyl-3-ethanoyl-4-sulfanyl-2H-pyrrol-5-one

Systemtic Name: 1-(4-chloranyl-2-fluoranyl-phenyl)-2-cyclohexyl-3-ethanoyl-4-sulfanyl-2H-pyrrol-5-one Openeye Name: 3-acetyl-1-(4-chloro-2-fluoro-phenyl)-2-cyclohexyl-4-sulfanyl-2H-pyrrol-5-one CAS Name: 3-acetyl-1-(4-chloro-2-fluorophenyl)-2-cyclohexyl-4-mercapto-2H-pyrrol-5-one IUPAC Name: 3-acetyl-1-(4-chloro-2-fluorophenyl)-2-cyclohexyl-4-sulfanyl-2H-pyrrol-5-one Traditional Name: 4-acetyl-1-(4-chloro-2-fluoro-phenyl)-5-cyclohexyl-3-mercapto-3-pyrrolin-2-one Formula: C18H19ClFNO2S MolecularWeight: 367.865363

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(C1C2CCCCC2)C3=C(C=C(C=C3)Cl)F)S

Isomeric SMILES

CC(=O)C1=C(C(=O)N(C1C2CCCCC2)C3=C(C=C(C=C3)Cl)F)S

InChI

InChI=1S/C18H19ClFNO2S/c1-10(22)15-16(11-5-3-2-4-6-11)21(18(23)17(15)24)14-8-7-12(19)9-13(14)20/h7-9,11,16,24H,2-6H2,1H3