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Aryl-phenylketones

Description:

Aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
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  1. Tienilic Acid
    Cas Number: 40180-04-9        EC Number: 254-826-3        Compound CID:  38409
    Formula:  C13H8Cl2O4S        Molecular Weight: 331.17
    IUPAC Name:  2-[2,3-dichloro-4-(thiophene-2-carbonyl)phenoxy]acetic acid
    SMILES:  C1=CSC(=C1)C(=O)C2=C(C(=C(C=C2)OCC(=O)O)Cl)Cl
    InChIKey: AGHANLSBXUWXTB-UHFFFAOYSA-N
    InChI:  InChI=1S/C13H8Cl2O4S/c14-11-7(13(18)9-2-1-5-20-9)3-4-8(12(11)15)19-6-10(16)17/h1-5H,6H2,(H,16,17)
    Synonyms: [2,3-Dichloro-4-(2-thienylcarbonyl)phenoxy]-acetic acid | Tienylic acid | Ticrynafen
  2. Zomepirac sodium salt
      Grade & Purity: 
    • ≥99%
    Cas Number: 64092-48-4        Compound CID:  16220118
    Formula:  C15H13ClNO3Na        Molecular Weight: 313.71
    IUPAC Name:  sodium;2-[5-(4-chlorobenzoyl)-1,4-dimethylpyrrol-2-yl]acetate
    SMILES:  CC1=C(N(C(=C1)CC(=O)[O-])C)C(=O)C2=CC=C(C=C2)Cl.[Na+]
    InChIKey: SEEXPXUCHVGZGU-UHFFFAOYSA-M
    InChI:  InChI=1S/C15H14ClNO3.Na/c1-9-7-12(8-13(18)19)17(2)14(9)15(20)10-3-5-11(16)6-4-10;/h3-7H,8H2,1-2H3,(H,18,19);/q;+1/p-1
  3. 2-Chloro-N-(3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl)acetamide
      Grade & Purity: 
    • ≥97%
    Cas Number: 50508-89-9        Compound CID:  12562369
    Formula:  C15H13Cl2NO2S        Molecular Weight: 342.2
    IUPAC Name:  2-chloro-N-[3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl]acetamide
    SMILES:  CCC1=CC(=C(S1)NC(=O)CCl)C(=O)C2=CC=CC=C2Cl
    InChIKey: RWDKLJQZPVCCTO-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H13Cl2NO2S/c1-2-9-7-11(15(21-9)18-13(19)8-16)14(20)10-5-3-4-6-12(10)17/h3-7H,2,8H2,1H3,(H,18,19)
  4. (5-chloro-1H-pyrrol-2-yl)(phenyl)methanone
      Grade & Purity: 
    • ≥95%
    Cas Number: 142231-06-9
    Formula:  C11H8ClNO        Molecular Weight: 205.64
    SMILES:  C1=CC=C(C=C1)C(=O)C2=CC=C(N2)Cl
    InChIKey: PKOYUCYDNKHXNN-UHFFFAOYSA-N
    InChI:  InChI=1S/C11H8ClNO/c12-10-7-6-9(13-10)11(14)8-4-2-1-3-5-8/h1-7,13H
  5. 3-(4-BROMO-2-FLUOROBENZOYL)THIOPHENE
      Grade & Purity: 
    • ≥98%
    Cas Number: 898771-38-5        Compound CID:  24723410
    Formula:  C11H6BrFOS        Molecular Weight: 285.13
    IUPAC Name:  (4-bromo-2-fluorophenyl)-thiophen-3-ylmethanone
    SMILES:  C1=CC(=C(C=C1Br)F)C(=O)C2=CSC=C2
    InChIKey: GTZFIVILTBBWAE-UHFFFAOYSA-N
    InChI:  InChI=1S/C11H6BrFOS/c12-8-1-2-9(10(13)5-8)11(14)7-3-4-15-6-7/h1-6H
  6. 2H-1-Benzopyran-2-one,3-benzoyl-7-(diethylamino)-
      Grade & Purity: 
    • ≥95%
    Cas Number: 77016-78-5
    Formula:  C20H19NO3        Molecular Weight: 321.3698
    SMILES:  CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)C3=CC=CC=C3
    InChIKey: CPVJWBWVJUAOMV-UHFFFAOYSA-N
    InChI:  InChI=1S/C20H19NO3/c1-3-21(4-2)16-11-10-15-12-17(20(23)24-18(15)13-16)19(22)14-8-6-5-7-9-14/h5-13H,3-4H2,1-2H3
  7. 2-(3,5-Dichlorobenzoyl)oxazole
      Grade & Purity: 
    • ≥95%
    Cas Number: 898784-28-6        Compound CID:  24723680
    Formula:  C10H5Cl2NO2        Molecular Weight: 242.06
    IUPAC Name:  (3,5-dichlorophenyl)-(1,3-oxazol-2-yl)methanone
    SMILES:  C1=COC(=N1)C(=O)C2=CC(=CC(=C2)Cl)Cl
    InChIKey: FALFWGLRGMSTDS-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H5Cl2NO2/c11-7-3-6(4-8(12)5-7)9(14)10-13-1-2-15-10/h1-5H
  8. 1H-Pyrrolizin-1-one, 5-benzoyl-2,3-dihydro-
      Grade & Purity: 
    • ≥95%
    Cas Number: 113502-52-6        Compound CID:  57357361
    Formula:  C14H11NO2        Molecular Weight: 225.24
    IUPAC Name:  5-benzoyl-2,3-dihydropyrrolizin-1-one
    SMILES:  C1CN2C(=CC=C2C(=O)C3=CC=CC=C3)C1=O
    InChIKey: NFKBMHXYCKRXPQ-UHFFFAOYSA-N
    InChI:  InChI=1S/C14H11NO2/c16-13-8-9-15-11(13)6-7-12(15)14(17)10-4-2-1-3-5-10/h1-7H,8-9H2
  9. 3-Benzoyl-7-Hydroxy-2H-Chromen-2-One
      Grade & Purity: 
    • ≥97%
    Cas Number: 19088-67-6        Compound CID:  5413038
    Formula:  C16H10O4        Molecular Weight: 266.25
    IUPAC Name:  3-benzoyl-7-hydroxychromen-2-one
    SMILES:  C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C(C=C3)O)OC2=O
    InChIKey: UWQPLMCCTUJLSP-UHFFFAOYSA-N
    InChI:  InChI=1S/C16H10O4/c17-12-7-6-11-8-13(16(19)20-14(11)9-12)15(18)10-4-2-1-3-5-10/h1-9,17H
  10. (4-Chloro-2-fluorophenyl)(6-chloro-2-methyl-8-(morpholinomethyl)imidazo[1,2-b]pyridazin-3-yl)methanone
      Grade & Purity: 
    • ≥98%
    Cas Number: 1229236-83-2        Compound CID:  56954584
    Formula:  C19H17Cl2FN4O2        Molecular Weight: 423.28
    IUPAC Name:  (4-chloro-2-fluorophenyl)-[6-chloro-2-methyl-8-(morpholin-4-ylmethyl)imidazo[1,2-b]pyridazin-3-yl]methanone
    SMILES:  CC1=C(N2C(=N1)C(=CC(=N2)Cl)CN3CCOCC3)C(=O)C4=C(C=C(C=C4)Cl)F
    InChIKey: WXZUHCAKLKTCGB-UHFFFAOYSA-N
    InChI:  InChI=1S/C19H17Cl2FN4O2/c1-11-17(18(27)14-3-2-13(20)9-15(14)22)26-19(23-11)12(8-16(21)24-26)10-25-4-6-28-7-5-25/h2-3,8-9H,4-7,10H2,1H3
  11. (4-Chlorophenyl)(1H-imidazol-2-yl)methanone
      Grade & Purity: 
    • ≥95%
    Cas Number: 62457-94-7        Compound CID:  4403088
    Formula:  C10H7ClN2O        Molecular Weight: 206.63
    IUPAC Name:  (4-chlorophenyl)-(1H-imidazol-2-yl)methanone
    SMILES:  C1=CC(=CC=C1C(=O)C2=NC=CN2)Cl
    InChIKey: DRMOGKAKDDNQDD-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H7ClN2O/c11-8-3-1-7(2-4-8)9(14)10-12-5-6-13-10/h1-6H,(H,12,13)
  12. (4-Chlorophenyl)(1H-pyrrol-3-yl)methanone
      Grade & Purity: 
    • ≥97%
    Cas Number: 62128-38-5        Compound CID:  12648632
    Formula:  C11H8ClNO        Molecular Weight: 205.64
    IUPAC Name:  (4-chlorophenyl)-(1H-pyrrol-3-yl)methanone
    SMILES:  C1=CC(=CC=C1C(=O)C2=CNC=C2)Cl
    InChIKey: AHSLXEUIQZMKFA-UHFFFAOYSA-N
    InChI:  InChI=1S/C11H8ClNO/c12-10-3-1-8(2-4-10)11(14)9-5-6-13-7-9/h1-7,13H
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