
IUPAC name
2-[(1Z)-5-fluoro-1-[(4-methanesulfinylphenyl)methylidene]-2-methyl-1H-inden-3-yl]acetic acid
SMILES
CC1=C(CC(O)=O)C2=CC(F)=CC=C2\C1=C/C1=CC=C(C=C1)S(C)=O
Compound class
Antineoplastic Agents; Anti-Inflammatory Agents, Non-Steroidal; Cyclooxygenase Inhibitors; Musculo-Skeletal System; Acetic Acid Derivatives and Related Substances; Antiinflammatory and Antirheumatic Products, Non-Steroids; Antiinflammatory and Antirheumatic Products; Cytochrome P-450 CYP1A2 Inhibitors; Cytochrome P-450 CYP1A2 Inducers;
Therapeutic area
For acute or long-term use in the relief of signs and symptoms of osteoarthritis, rheumatoid arthritis, ankylosing spondylitis, acute painful shoulder (acute subacromial bursitis/supraspinatus tendinitis), and acute gouty arthritis.
Common name
Sulindac
IUPAC name
2-[(1Z)-5-fluoro-1-[(4-methanesulfinylphenyl)methylidene]-2-methyl-1H-inden-3-yl]acetic acid
SMILES
CC1=C(CC(O)=O)C2=CC(F)=CC=C2\C1=C/C1=CC=C(C=C1)S(C)=O
INCHI
InChI=1S/C20H17FO3S/c1-12-17(9-13-3-6-15(7-4-13)25(2)24)16-8-5-14(21)10-19(16)18(12)11-20(22)23/h3-10H,11H2,1-2H3,(H,22,23)/b17-9-
FORMULA
C20H17FO3S

Common name
Sulindac
IUPAC name
2-[(1Z)-5-fluoro-1-[(4-methanesulfinylphenyl)methylidene]-2-methyl-1H-inden-3-yl]acetic acid
Molecular weight
356.411
clogP
4.259
clogS
-5.491
HBond Acceptor
3
HBond Donor
1
Total Polar Surface Area
54.37
Number of Rings
3
Rotatable Bond
4
Drug ID | Common name | Structure CAS | SMILE | Frequency |
---|---|---|---|---|
FDBF00004 | acetic acid |
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CC(=O)O | 0.0687 |
FDBF00005 | benzene |
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c1ccccc1 | 0.2824 |
FDBF00356 | hydroxysulfanylmethane |
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S(O)C | 0.0069 |
FDBF01375 | [hydroxy(methyl)-λ3-sulfanyl]benzene |
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c1ccc(cc1)[S](O)C | 0.0010 |
FDBF01376 | 2-(6-fluoro-2,3-dimethyl-5H-inden-1-yl)acetic acid |
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C(C(=O)O)C1=C2C=C(CC=C2C(=C1C)C)F | 0.0003 |