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Substance Name: Polythiazide mixture with reserpine
RN: 60747-11-7
InChIKey: AOVLLWMIDXRCTA-BQTSRIDJSA-N

Molecular Formula

  • C33-H40-N2-O9.C11-H13-Cl-F3-N3-O4-S3

Molecular Weight

  • 1048.5697
 
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Names and Synonyms

Name of Substance

  • Polythiazide mixture with reserpine

Synonyms

  • Polythiazide - reserpine
  • Polythiazide and reserp
  • Renese-R

Systematic Name

  • Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-((3,4,5- trimethoxybenzoyl)oxy)-, methyl ester, (3beta,16beta,17alpha,18beta,20alpha)-, mixt. with 6-chloro-3,4-dihydro-2-methyl-3-(((2,2,2-trifluoroethyl)thio)methyl)-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide

Registry Numbers

CAS Registry Number

  • 60747-11-7

System Generated Number

  • 0060747117

Molecular Formulas

Molecular Formula

  • C33-H40-N2-O9.C11-H13-Cl-F3-N3-O4-S3

Molecular Formula Fragments

  • C11-H13-Cl-F3-N3-O4-S3
  • C33-H40-N2-O9
  • COMPONENT

Structure Descriptors

InChI

1S/C33H40N2O9.C11H13ClF3N3O4S3/c1-38-19-7-8-20-21-9-10-35-16-18-13-27(44-32(36)17-11-25(39-2)30(41-4)26(12-17)40-3)31(42-5)28(33(37)43-6)22(18)15-24(35)29(21)34-23(20)14-19;1-18-10(4-23-5-11(13,14)15)17-7-2-6(12)8(24(16,19)20)3-9(7)25(18,21)22/h7-8,11-12,14,18,22,24,27-28,31,34H,9-10,13,15-16H2,1-6H3;2-3,10,17H,4-5H2,1H3,(H2,16,19,20)/t18-,22+,24-,27-,28+,31+;/m1./s1

InChIKey

AOVLLWMIDXRCTA-BQTSRIDJSA-N

Smiles

CN1C(Nc2cc(c(cc2S1(=O)=O)S(=O)(=O)N)Cl)CSCC(F)(F)F.COc1ccc2c(c1)[nH]c3c2CCN4[C@@H]3C[C@H]5[C@@H](C4)C[C@H]([C@@H]([C@H]5C(=O)OC)OC)OC(=O)c6cc(c(c(c6)OC)OC)OC