Chemical identity

2-((1r,4r)-4-(3,3-Dimethylureido)cyclohexyl)ethyl 4-Methylbenzenesulfonate

CAS 1698050-46-2 · C18H28N2O4S

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-09539
PubChem CID168430001
Name2-((1r,4r)-4-(3,3-Dimethylureido)cyclohexyl)ethyl 4-Methylbenzenesulfonate
CAS RN1698050-46-2
Molecular formulaC18H28N2O4S
Molecular weight368.49 g/mol
IUPAC name2-((1r,4r)-4-(3,3-dimethylureido)cyclohexyl)ethyl 4-methylbenzenesulfonate
InChIKeyLXDFKNZTVPIKFY-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 168430001
Two-dimensional chemical structure of 2-((1r,4r)-4-(3,3-Dimethylureido)cyclohexyl)ethyl 4-Methylbenzenesulfonate, CAS 1698050-46-2
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 2 rings, includes aromatic atoms, includes aliphatic carbon. These statements are calculated from the published structure string.

Defined stereocentres0
Unassigned stereocentres0
Ring count2
Secondary amines0
Tertiary amines0
N-methyl amine sites0
SMILESCC1=CC=C(C=C1)S(=O)(=O)OCCC2CCC(CC2)NC(=O)N(C)C
InChINot listed
Formula from structureC18H28N2O4S
Molecular weight from structure368.49 g/mol

03India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNO EXACT MATCH FOUNDCAS 1698050-46-2 has no exact match in the reviewed published schedule.
SCOMETNO EXACT REVIEWED CAS MATCHCAS 1698050-46-2 has no exact match in the reviewed SCOMET list.
Review date2026-08-01Recheck the current official instruments for the material, concentration, activity and date in question.

04Names and relationships

Associated parent compound

Cariprazine

View API and impurity family

Other names

  • Cariprazine Impurity 5
  • 2-((1r,4r)-4-(3,3-Dimethylureido)cyclohexyl)ethyl 4-Methylbenzenesulfonate
  • 1698050-46-2
  • SCHEMBL28406771
  • DB-403538
  • N,N-Dimethyl-N'-[trans-4-[2-[[(4-methylphenyl)sulfonyl]oxy]ethyl]cyclohexyl]urea
  • rel-2-((1r,4r)-4-(3,3-Dimethylureido)cyclohexyl)ethyl 4-methylbenzenesulfonate
  • Urea, N,N-dimethyl-N'-[trans-4-[2-[[(4-methylphenyl)sulfonyl]oxy]ethyl]cyclohexyl]-

Related records from the same parent family

05Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

06Sources