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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H20N4O5
Molecular Weight 420.418
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TALMETOPRIM

SMILES

COC1=CC(CC2=CN=C(N=C2N)N3C(=O)C4=CC=CC=C4C3=O)=CC(OC)=C1OC

InChI

InChIKey=MGBWNIUCAVQUCE-UHFFFAOYSA-N
InChI=1S/C22H20N4O5/c1-29-16-9-12(10-17(30-2)18(16)31-3)8-13-11-24-22(25-19(13)23)26-20(27)14-6-4-5-7-15(14)21(26)28/h4-7,9-11H,8H2,1-3H3,(H2,23,24,25)

HIDE SMILES / InChI

Molecular Formula C22H20N4O5
Molecular Weight 420.418
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:35:18 GMT 2023
Edited
by admin
on Fri Dec 15 16:35:18 GMT 2023
Record UNII
X8W4CW0QHK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TALMETOPRIM
INN  
INN  
Official Name English
talmetoprim [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C28394
Created by admin on Fri Dec 15 16:35:18 GMT 2023 , Edited by admin on Fri Dec 15 16:35:18 GMT 2023
Code System Code Type Description
FDA UNII
X8W4CW0QHK
Created by admin on Fri Dec 15 16:35:18 GMT 2023 , Edited by admin on Fri Dec 15 16:35:18 GMT 2023
PRIMARY
CAS
66093-35-4
Created by admin on Fri Dec 15 16:35:18 GMT 2023 , Edited by admin on Fri Dec 15 16:35:18 GMT 2023
PRIMARY
SMS_ID
100000083206
Created by admin on Fri Dec 15 16:35:18 GMT 2023 , Edited by admin on Fri Dec 15 16:35:18 GMT 2023
PRIMARY
NCI_THESAURUS
C77060
Created by admin on Fri Dec 15 16:35:18 GMT 2023 , Edited by admin on Fri Dec 15 16:35:18 GMT 2023
PRIMARY
ChEMBL
CHEMBL2104875
Created by admin on Fri Dec 15 16:35:18 GMT 2023 , Edited by admin on Fri Dec 15 16:35:18 GMT 2023
PRIMARY
INN
4591
Created by admin on Fri Dec 15 16:35:18 GMT 2023 , Edited by admin on Fri Dec 15 16:35:18 GMT 2023
PRIMARY
EVMPD
SUB10809MIG
Created by admin on Fri Dec 15 16:35:18 GMT 2023 , Edited by admin on Fri Dec 15 16:35:18 GMT 2023
PRIMARY
EPA CompTox
DTXSID90867205
Created by admin on Fri Dec 15 16:35:18 GMT 2023 , Edited by admin on Fri Dec 15 16:35:18 GMT 2023
PRIMARY
PUBCHEM
163307
Created by admin on Fri Dec 15 16:35:18 GMT 2023 , Edited by admin on Fri Dec 15 16:35:18 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY