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Substance Name: Urea, N(sup 1)-(6-chloro-5-(2-fluorophenyl)-2,3-dihydro-1-methyl-2-oxo-1H-1,4-benzodiazepin-7-yl)-N,N-diethyl-
RN: 74858-77-8
InChIKey: HKNJUTISUDVCPE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H22-Cl-F-N4-O2

Molecular Weight

  • 416.8818
 
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Names and Synonyms

  • Urea, N(sup 1)-(6-chloro-5-(2-fluorophenyl)-2,3-dihydro-1-methyl-2-oxo-1H-1,4-benzodiazepin-7-yl)-N,N-diethyl-

Registry Numbers

CAS Registry Number

  • 74858-77-8

System Generated Number

  • 0074858778

Structure Descriptors

InChI

1S/C21H22ClFN4O2/c1-4-27(5-2)21(29)25-15-10-11-16-18(19(15)22)20(24-12-17(28)26(16)3)13-8-6-7-9-14(13)23/h6-11H,4-5,12H2,1-3H3,(H,25,29)

InChIKey

HKNJUTISUDVCPE-UHFFFAOYSA-N

Smiles

CCN(CC)C(=O)Nc1ccc2c(c1Cl)C(=NCC(=O)N2C)c3ccccc3F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 5gm/kg (5000mg/kg)   United States Patent Document. Vol. #4294758,