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Substance Name: L-Cysteine, N-acetyl-S-(2-((2,4-dibromo-6-((cyclohexylmethylamino)methyl)phenyl)amino)-2-oxoethyl)-, methyl ester
RN: 97290-45-4
InChIKey: YALTVVAYZZHMBU-IBGZPJMESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H31-Br2-N3-O4-S

Molecular Weight

  • 593.3779
 
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Names and Synonyms

  • L-Cysteine, N-acetyl-S-(2-((2,4-dibromo-6-((cyclohexylmethylamino)methyl)phenyl)amino)-2-oxoethyl)-, methyl ester

Registry Numbers

CAS Registry Number

  • 97290-45-4

System Generated Number

  • 0097290454

Structure Descriptors

InChI

1S/C22H31Br2N3O4S/c1-14(28)25-19(22(30)31-3)12-32-13-20(29)26-21-15(9-16(23)10-18(21)24)11-27(2)17-7-5-4-6-8-17/h9-10,17,19H,4-8,11-13H2,1-3H3,(H,25,28)(H,26,29)/t19-/m0/s1

InChIKey

YALTVVAYZZHMBU-IBGZPJMESA-N

Smiles

c1(c(c(cc(c1)Br)Br)NC(=O)CSC[C@@H](C(=O)OC)NC(=O)C)CN(C1CCCCC1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 303mg/kg (303mg/kg)   Farmaco, Edizione Scientifica. Vol. 40, Pg. 108, 1985.
mouse LD50 oral > 3026mg/kg (3026mg/kg)   Farmaco, Edizione Scientifica. Vol. 40, Pg. 108, 1985.