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Substance Name: Pyrrolidine, 1-(1-(3-(2-chlorophenothiazin-10-yl)propyl)-4-(m-chlorophenyl)isonipecotoyl)-, monohydrochloride, hydrate
RN: 23977-57-3
InChIKey: HDIDVBVFLOQODB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C31-H33-Cl2-N3-O-S.Cl-H.H2-O

Molecular Weight

  • 603.055
 
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Names and Synonyms

Synonym

  • 1-(1-(3-(2-Chlorophenothiazin-10-yl)propyl)-4-(m-chlorophenyl)isonipecotoyl)pyrrolidine HCl

Systematic Name

  • Pyrrolidine, 1-(1-(3-(2-chlorophenothiazin-10-yl)propyl)-4-(m-chlorophenyl)isonipecotoyl)-, monohydrochloride, hydrate

Registry Numbers

CAS Registry Number

  • 23977-57-3

System Generated Number

  • 0023977573

Molecular Formulas

Molecular Formula

  • C31-H33-Cl2-N3-O-S.Cl-H.H2-O

Molecular Formula Fragments

  • C31-H33-Cl2-N3-O-S
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C31H33Cl2N3OS.ClH/c32-24-8-5-7-23(21-24)31(30(37)35-16-3-4-17-35)13-19-34(20-14-31)15-6-18-36-26-9-1-2-10-28(26)38-29-12-11-25(33)22-27(29)36;/h1-2,5,7-12,21-22H,3-4,6,13-20H2;1H

InChIKey

HDIDVBVFLOQODB-UHFFFAOYSA-N

Smiles

N1(CCCC1)C(C1(CCN(CC1)CCCN1c2ccccc2Sc2ccc(cc12)Cl)c1cc(ccc1)Cl)=O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 320mg/kg (320mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 644, 1970.