Mrv0541 12171407572D          

 22 24  0  0  0  0            999 V2000
    1.6772   -2.9102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6772   -2.0852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9772   -0.8352    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9772   -3.3352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4022   -3.3352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1272   -2.9102    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9772   -1.6852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9772   -4.1602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2522   -2.9102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4728   -3.3352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2522   -4.5852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4728   -4.1602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6022   -0.3602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3272   -0.3352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8522   -3.3352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4022   -4.1602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1978   -4.6102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5772    0.3898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3772    0.3898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8522   -4.1602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1272   -4.5852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4022   -1.6602    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  4  1  1  0  0  0  0
  5  1  1  0  0  0  0
  7  2  1  0  0  0  0
 22  2  1  0  0  0  0
  7  3  1  0  0  0  0
 13  3  1  0  0  0  0
 14  3  1  0  0  0  0
  8  4  2  0  0  0  0
  9  4  1  0  0  0  0
  6  5  1  0  0  0  0
 16  5  2  0  0  0  0
 15  6  2  0  0  0  0
 11  8  1  0  0  0  0
 10  9  2  0  0  0  0
 12 10  1  0  0  0  0
 12 11  2  0  0  0  0
 17 12  1  0  0  0  0
 19 13  1  0  0  0  0
 18 14  1  0  0  0  0
 20 15  1  0  0  0  0
 21 16  1  0  0  0  0
 19 18  1  0  0  0  0
 21 20  2  0  0  0  0
M  END
> <ID>
CHEBI:84116

> <NAME>
triprolidine

> <DEFINITION>
An N-alkylpyrrolidine that is acrivastine in which the pyridine ring is lacking the propenoic acid substituent. It is a sedating antihistamine that is used (generally as the monohydrochloride monohydrate) for the relief of the symptoms of uticaria, rhinitis, and various pruritic skin disorders.

> <STAR>
3

> <SYNONYM>
trans-2-(3-(1-pyrrolidinyl)-1-p-tolylpropenyl)pyridine; trans-1-(4-methylphenyl)-1-(2-pyridyl)-3-pyrrolidinoprop-1-ene; trans-1-(2-pyridyl)-3-pyrrolidino-1-p-tolylprop-1-ene; (E)-2-[3-(1-pyrrolidinyl)-1-p-toluenepropenyl]pyridine

> <IUPAC_NAME>
2-[(1E)-1-(4-methylphenyl)-3-(pyrrolidin-1-yl)prop-1-en-1-yl]pyridine

> <INN>
triprolidinum; triprolidine; triprolidine; tripolidina

> <FORMULA>
C19H22N2

> <MASS>
278.39140

> <MONOISOTOPIC_MASS>
278.17830

> <CHARGE>
0

> <SMILES>
Cc1ccc(cc1)C(=C/CN1CCCC1)\c1ccccn1

> <INCHI>
InChI=1S/C19H22N2/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21/h2-3,6-12H,4-5,13-15H2,1H3/b18-11+

> <INCHIKEY>
CBEQULMOCCWAQT-WOJGMQOQSA-N

> <CAS_REGISTRY_NUMBER>
486-12-4

> <REAXYS_REGISTRY_NUMBER>
87215

> <CHEMIDPLUS>
486-12-4

> <DRUGBANK_ACCESSION>
DB00427

> <KEGG_DRUG_ACCESSION>
D08648

> <NIST_CHEMISTRY_WEBBOOK>
486-12-4

> <WIKIPEDIA_ACCESSION>
Triprolidine

> <PUBMED_CITATION>
1362947; 1362948; 3944383; 6509877; 7258744; 8529817

$$$$