Chemical identity

N3-Benzyl Medetomidine

CAS 2197018-01-0 · C20H22N2

01Identity

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

Lazychem IDLC-22949
PubChem CID140308765
NameN3-Benzyl Medetomidine
CAS RN2197018-01-0
Molecular formulaC20H22N2
Molecular weight290.41 g/mol
IUPAC name1-benzyl-4-(1-(2,3-dimethylphenyl)ethyl)-1H-imidazole
InChIKeyKSWJRJLHRWQUBO-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 140308765
Two-dimensional chemical structure of N3-Benzyl Medetomidine, CAS 2197018-01-0
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 3 rings, includes aromatic atoms, includes aliphatic carbon. These statements are calculated from the published structure string.

Defined stereocentres0
Unassigned stereocentres1
Ring count3
Secondary amines0
Tertiary amines0
N-methyl amine sites0
SMILESCC1=C(C(=CC=C1)C(C)C2=CN(C=N2)CC3=CC=CC=C3)C
InChINot listed
Formula from structureC20H22N2
Molecular weight from structure290.41 g/mol

03Stereochemistry

The published structure contains 0 defined and 1 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned
Unassigned centres1Structure unspecified
Assignment statusUnassignedExact published identity
Tetrahedral upper bound≤ 2Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04India 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 2197018-01-0 has no exact match in the reviewed published schedule.
SCOMETNO EXACT REVIEWED CAS MATCHCAS 2197018-01-0 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.

05Names and relationships

Associated parent compound

Medetomidine

View API and impurity family

Other names

  • N3-Benzyl Medetomidine / Medetomidine Impurity 51
  • N3-Benzyl Medetomidine
  • Medetomidine Impurity 51
  • 1-benzyl-4-(1-(2,3-dimethylphenyl)ethyl)-1H-imidazole
  • 2197018-01-0
  • FB167042

Related records from the same parent family

06Documented 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.

07Sources