Tubulozole

CAS Registry Number®

84697-22-3

CAS Name

Tubulozole

Molecular Formula

C23H23Cl2N3O4S

Molecular Mass

508.42

Cite this Page

Tubulozole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=84697-22-3 (retrieved 2024-11-23) (CAS RN: 84697-22-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C23H23Cl2N3O4S/c1-2-30-22(29)27-17-4-6-19(7-5-17)33-13-18-12-31-23(32-18,14-28-10-9-26-15-28)20-8-3-16(24)11-21(20)25/h3-11,15,18H,2,12-14H2,1H3,(H,27,29)/t18-,23+/s2

InChIKey

InChIKey=OGPIBXIQNMQSPY-FSXCQAEWNA-N

SMILES

C([C@]1(O[C@@H](CSC2=CC=C(NC(OCC)=O)C=C2)CO1)C3=C(Cl)C=C(Cl)C=C3)N4C=CN=C4

Canonical SMILES

O=C(OCC)NC1=CC=C(SCC2OC(OC2)(C3=CC=C(Cl)C=C3Cl)CN4C=NC=C4)C=C1

Other Names for this Substance

  • Carbamic acid, N-[4-[[[(2R,4R)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl]thio]phenyl]-, ethyl ester, rel-
  • Carbamic acid, [4-[[[2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl]thio]phenyl]-, ethyl ester, cis-(±)-
  • Carbamic acid, [4-[[[(2R,4R)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl]thio]phenyl]-, ethyl ester, rel-
  • Tubulozole
  • R 46846

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Deleted or Replaced CAS Registry Numbers

83086-67-3

CAS INSIGHTSTM
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