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Substance Name: Morpholine, 4-(3-(4-(2-chlorophenyl)-9-methoxy-4H-thieno(3,2-f)(1,2,4)triazolo(4,3-a)(1,4)diazepin-2-yl)-1-oxopropyl)-
RN: 105241-82-5
InChIKey: YSRZVJFMKDVWBW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H22-Cl-N5-O3-S

Molecular Weight

  • 471.9668
 
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Names and Synonyms

  • Morpholine, 4-(3-(4-(2-chlorophenyl)-9-methoxy-4H-thieno(3,2-f)(1,2,4)triazolo(4,3-a)(1,4)diazepin-2-yl)-1-oxopropyl)-

Registry Numbers

CAS Registry Number

  • 105241-82-5

System Generated Number

  • 0105241825

Structure Descriptors

InChI

1S/C22H22ClN5O3S/c1-30-22-26-25-18-13-24-20(15-4-2-3-5-17(15)23)16-12-14(32-21(16)28(18)22)6-7-19(29)27-8-10-31-11-9-27/h2-5,12-13,20H,6-11H2,1H3

InChIKey

YSRZVJFMKDVWBW-UHFFFAOYSA-N

Smiles

COc1nnc2n1-c3c(cc(s3)CCC(=O)N4CCOCC4)C(N=C2)c5ccccc5Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 400mg/kg (400mg/kg)   United States Patent Document. Vol. #4968794,
mouse LD50 oral 3gm/kg (3000mg/kg)   United States Patent Document. Vol. #4968794,