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Substance Name: Clentiazem maleate [USAN]
RN: 96128-92-6
UNII: YN4F0N5QE0
InChIKey: FTUXVMVEKYLKGE-WECFPGDBSA-N

Classification Codes

  • Antagonist (Calcium Channel)
  • Drug / Therapeutic Agent
  • Reproductive Effect

Molecular Formula

  • C22-H25-Cl-N2-O4-S.C4-H4-O4

Molecular Weight

  • 565.0401
 
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Names and Synonyms

Name of Substance

  • Clentiazem maleate
  • Clentiazem maleate [USAN]

Synonyms

  • (+)-(2S,3S)-8-Chloro-5-(2-(dimethylamino)ethyl)-2,3-dihydro-3-hydroxy-2-(p-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one acetate (ester), maleate (1:1)
  • (S,S)-Clentiazem maleate
  • 1,5-Benzothiazepin-4(5H)-one, 3-(acetyloxy)-8-chloro-5-(2-(dimethylamino)ethyl)-2,3-dihydro-2-(4-methoxyphenyl)-, (2S-cis)-, (Z)-2-butenedioate (1:1)
  • Clentiazem maleate
  • TA 3090
  • TA-3090
  • UNII-YN4F0N5QE0

Systematic Names

  • 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-3-(acetyloxy)-8-chloro-5-(2-(dimethylamino)ethyl)-2-(4-methoxyphenyl)-, (2S-cis)-, (Z)-2-butenedioate (1:1)
  • 1,5-Benzothiazepin-4(5H)-one, 3-(acetyloxy)-8-chloro-5-(2-(dimethylamino)ethyl)-2,3-dihydro-2-(4-methoxyphenyl)-, (2S,3S)-, (2Z)-2-butenedioate (1:1)
  • 1,5-Benzothiazepin-4(5H)-one, 3-(acetyloxy)-8-chloro-5-(2-(dimethylamino)ethyl)-2,3-dihydro-2-(4-methoxyphenyl)-, (2S-cis)-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 96128-92-6

FDA UNII

  • YN4F0N5QE0

System Generated Number

  • 0096128926

Molecular Formulas

Molecular Formula

  • C22-H25-Cl-N2-O4-S.C4-H4-O4

Molecular Formula Fragments

  • C22-H25-Cl-N2-O4-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C22H25ClN2O4S.C4H4O4/c1-14(26)29-20-21(15-5-8-17(28-4)9-6-15)30-19-13-16(23)7-10-18(19)25(22(20)27)12-11-24(2)3;5-3(6)1-2-4(7)8/h5-10,13,20-21H,11-12H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t20-,21+;/m1./s1

InChIKey

FTUXVMVEKYLKGE-WECFPGDBSA-N

Smiles

COc1ccc(cc1)[C@@H]2Sc3cc(Cl)ccc3N(CCN(C)C)C(=O)[C@@H]2OC(=O)C.OC(=O)\C=C/C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 800mg/kg (800mg/kg)   European Patent Application. Vol. #501442,