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Substance Name: Phenothiazine, 10-(3-(dimethylamino)-2-methylpropyl)-2-nitro-, maleate
RN: 100735-03-3
InChIKey: BDULXYUQRNNEEB-BTJKTKAUSA-N

Molecular Formula

  • C18-H21-N3-O2-S.C4-H4-O4

Molecular Weight

  • 459.5205
 
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Names and Synonyms

Synonyms

  • 10-(3-(Dimethylamino)-2-methylpropyl)-2-nitrophenothiazine maleate
  • 2-Nitro-10-(3-dimethylamino-2-methylpropyl)phenothiazine, maleate

Systematic Name

  • Phenothiazine, 10-(3-(dimethylamino)-2-methylpropyl)-2-nitro-, maleate

Registry Numbers

CAS Registry Number

  • 100735-03-3

System Generated Number

  • 0100735033

Molecular Formulas

Molecular Formula

  • C18-H21-N3-O2-S.C4-H4-O4

Molecular Formula Fragments

  • C18-H21-N3-O2-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C18H21N3O2S.C4H4O4/c1-13(11-19(2)3)12-20-15-6-4-5-7-17(15)24-18-9-8-14(21(22)23)10-16(18)20;5-3(6)1-2-4(7)8/h4-10,13H,11-12H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

BDULXYUQRNNEEB-BTJKTKAUSA-N

Smiles

CC(CN1c2ccccc2Sc3c1cc(cc3)[N+](=O)[O-])CN(C)C.C(=C\C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 50mg/kg (50mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#07199,