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Substance Name: NSC 288747
RN: 20884-90-6
InChIKey: FMUVIFLFKIUPHK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H25-N-O4-S

Molecular Weight

  • 375.487
 
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Names and Synonyms

Results Name

  • NSC 288747

Synonyms

  • 1,2,3,4-Tetrahydro-1-(p-(isopropylsulfonyl)phenyl)-6,7-dimethoxy-isoquinoline
  • 5-21-05-00597 (Beilstein Handbook Reference)
  • BRN 1510102
  • NSC 288747

Systematic Name

  • Isoquinoline, 1,2,3,4-tetrahydro-1-(p-(isopropylsulfonyl)phenyl)-6,7-dimethoxy-

Registry Numbers

CAS Registry Number

  • 20884-90-6

System Generated Number

  • 0020884906

Structure Descriptors

InChI

1S/C20H25NO4S/c1-13(2)26(22,23)16-7-5-14(6-8-16)20-17-12-19(25-4)18(24-3)11-15(17)9-10-21-20/h5-8,11-13,20-21H,9-10H2,1-4H3

InChIKey

FMUVIFLFKIUPHK-UHFFFAOYSA-N

Smiles

c12[C@@H](c3ccc(S(C(C)C)(=O)=O)cc3)NCCc1cc(OC)c(c2)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 300mg/kg (300mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 1023, 1968.