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Substance Name: Benzamide, 4-amino-5-(ethylsulfonyl)-2-methoxy-N-((1-(2-propenyl)-2-pyrrolidinyl)methyl)-
RN: 71675-89-3
InChIKey: VHPLNJNSOIDOSX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H27-N3-O4-S

Molecular Weight

  • 381.4943
 
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Names and Synonyms

Synonym

  • N-((1-Allyl-2-pyrrolidinyl)methyl)-2-methoxy-4-amino-5-ethylsulphonylbenzamide

Systematic Name

  • Benzamide, 4-amino-5-(ethylsulfonyl)-2-methoxy-N-((1-(2-propenyl)-2-pyrrolidinyl)methyl)-

Registry Numbers

CAS Registry Number

  • 71675-89-3

System Generated Number

  • 0071675893

Structure Descriptors

InChI

1S/C18H27N3O4S/c1-4-8-21-9-6-7-13(21)12-20-18(22)14-10-17(26(23,24)5-2)15(19)11-16(14)25-3/h4,10-11,13H,1,5-9,12,19H2,2-3H3,(H,20,22)

InChIKey

VHPLNJNSOIDOSX-UHFFFAOYSA-N

Smiles

CCS(=O)(=O)c1cc(c(cc1N)OC)C(=O)NCC2CCCN2CC=C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 216mg/kg (216mg/kg)   United States Patent Document. Vol. #4401822,
mouse LD50 intravenous 106mg/kg (106mg/kg)   United States Patent Document. Vol. #4401822,
mouse LD50 oral 2232mg/kg (2232mg/kg)   United States Patent Document. Vol. #4401822,
mouse LD50 subcutaneous 312mg/kg (312mg/kg)   United States Patent Document. Vol. #4401822,