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Substance Name: Benzoic acid, 4-(4,5-dihydro-4-(1H-indolylmethylene)-4,5-dihydro-2-methyl-5-oxo-1H-imidazol-1-yl)-
RN: 100039-63-2
InChIKey: HJWKNTSKQQKAID-SFQUDFHCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H15-N3-O3

Molecular Weight

  • 345.3565
 
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Names and Synonyms

  • Benzoic acid, 4-(4,5-dihydro-4-(1H-indolylmethylene)-4,5-dihydro-2-methyl-5-oxo-1H-imidazol-1-yl)-

Registry Numbers

CAS Registry Number

  • 100039-63-2

System Generated Number

  • 0100039632

Structure Descriptors

InChI

1S/C20H15N3O3/c1-13-21-17(12-22-11-10-14-4-2-3-5-18(14)22)19(24)23(13)16-8-6-15(7-9-16)20(25)26/h2-12H,1H3,(H,25,26)/b17-12+

InChIKey

HJWKNTSKQQKAID-SFQUDFHCSA-N

Smiles

CC1=N/C(=C/n2ccc3c2cccc3)/C(=O)N1c4ccc(cc4)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Indian Drugs. Vol. 23, Pg. 13, 1985.