Chemical identity

N'-Methylsulfonyl Dofetilide

CAS 312315-47-2 · C20H29N3O7S3

01Identity

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

Lazychem IDLC-22917
PubChem CID169443867
NameN'-Methylsulfonyl Dofetilide
CAS RN312315-47-2
Molecular formulaC20H29N3O7S3
Molecular weight519.66 g/mol
IUPAC nameN-[4-[2-[Methyl[2-[4-[(methylsulfonyl)amino]phenoxy]ethyl]amino]ethyl]phenyl]-N-(methylsulfonyl)-methanesulfonamide
InChIKeyDVVVFDWNWGBMTE-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 169443867
2D structure: N'-Methylsulfonyl Dofetilide, CAS 312315-47-2
Structure of N'-Methylsulfonyl Dofetilide (CAS 312315-47-2). LazyChem record. Source identity: PubChem CID 169443867. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC20H29N3O7S3
InChIKeyDVVVFDWNWGBMTE-UHFFFAOYSA-N
Ring count2
Defined stereocentres0
Unassigned stereocentres0
SMILESCN(CCC1=CC=C(C=C1)N(S(=O)(=O)C)S(=O)(=O)C)CCOC2=CC=C(C=C2)NS(=O)(=O)C
InChIInChI=1S/C20H29N3O7S3/c1-22(15-16-30-20-11-7-18(8-12-20)21-31(2,24)25)14-13-17-5-9-19(10-6-17)23(32(3,26)27)33(4,28)29/h5-12,21H,13-16H2,1-4H3

03Possible N-nitroso structures

A record-level structural review indicates a possible N-nitroso candidate. This is not a confirmed impurity, formation prediction or analytical finding.

Possible structure candidateUnconfirmed identity
Possible N-nitroso structural candidate related to N'-Methylsulfonyl Dofetilide, CAS 312315-47-2
No CAS number, formation claim or analytical confirmation is assigned.

A structural result alone does not establish that a nitrosamine forms. A process-specific and analytical assessment is required.

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 / RCSNOT FOUND IN REVIEWED ENTRIESCAS 312315-47-2 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 312315-47-2 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

05Names and relationships

Associated parent compound

Dofetilide

View API and impurity family

Other names

No synonyms are listed.

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