U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C28H32N3S2.I
Molecular Weight 601.608
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TIBEZONIUM IODIDE

SMILES

[I-].CC[N+](C)(CC)CCSC1=NC2=C(C=CC=C2)N=C(C1)C3=CC=C(SC4=CC=CC=C4)C=C3

InChI

InChIKey=YTSPICCNZMNDQT-UHFFFAOYSA-M
InChI=1S/C28H32N3S2.HI/c1-4-31(3,5-2)19-20-32-28-21-27(29-25-13-9-10-14-26(25)30-28)22-15-17-24(18-16-22)33-23-11-7-6-8-12-23;/h6-18H,4-5,19-21H2,1-3H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula HI
Molecular Weight 127.9124
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C28H32N3S2
Molecular Weight 474.704
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:50:05 GMT 2023
Edited
by admin
on Fri Dec 15 15:50:05 GMT 2023
Record UNII
E9P274AJEW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TIBEZONIUM IODIDE
INN   MART.   MI   WHO-DD  
INN  
Official Name English
tibezonium iodide [INN]
Common Name English
NSC-308905
Code English
TIBEZONIUM IODIDE [MART.]
Common Name English
Tibezonium iodide [WHO-DD]
Common Name English
TIBEZONIUM IODIDE [MI]
Common Name English
Classification Tree Code System Code
WHO-ATC A01AB15
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
WHO-VATC QA01AB15
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
NCI_THESAURUS C28394
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
Code System Code Type Description
ECHA (EC/EINECS)
259-284-1
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY
NCI_THESAURUS
C72650
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY
EVMPD
SUB11021MIG
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY
FDA UNII
E9P274AJEW
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY
EPA CompTox
DTXSID60905128
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY
SMS_ID
100000092156
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY
PUBCHEM
6918582
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY
CAS
54663-47-7
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY
NSC
308905
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY
DRUG BANK
DB13702
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY
INN
3702
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY
WIKIPEDIA
TIBEZONIUM IODIDE
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY
MERCK INDEX
m10851
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY Merck Index
RXCUI
237141
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY RxNorm
ChEMBL
CHEMBL2111016
Created by admin on Fri Dec 15 15:50:05 GMT 2023 , Edited by admin on Fri Dec 15 15:50:05 GMT 2023
PRIMARY
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