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

Details

Stereochemistry ACHIRAL
Molecular Formula C15H20N4O3
Molecular Weight 304.3449
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-DESAMINO-2-METHYLAMINO TRIMETHOPRIM

SMILES

CN=c1[nH]cc(Cc2cc(c(c(c2)OC)OC)OC)c(=N)[nH]1

InChI

InChIKey=LCMRPHMVLYACMM-UHFFFAOYSA-N
InChI=1S/C15H20N4O3/c1-17-15-18-8-10(14(16)19-15)5-9-6-11(20-2)13(22-4)12(7-9)21-3/h6-8H,5H2,1-4H3,(H3,16,17,18,19)

HIDE SMILES / InChI

Molecular Formula C15H20N4O3
Molecular Weight 304.3449
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Jun 26 09:07:00 UTC 2021
Edited
by admin
on Sat Jun 26 09:07:00 UTC 2021
Record UNII
G6AV6588UC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-DESAMINO-2-METHYLAMINO TRIMETHOPRIM
Common Name English
TRIMETHOPRIM IMPURITY A [EP]
Common Name English
2,4-PYRIMIDINEDIAMINE, N2-METHYL-5-((3,4,5-TRIMETHOXYPHENYL)METHYL)-
Systematic Name English
N2-METHYL-5-((3,4,5-TRIMETHOXYPHENYL)METHYL)-2,4-PYRIMIDINEDIAMINE
Systematic Name English
4-AMINO-2-METHYLAMINO-5-(3,4,5-TRIMETHOXYBENZYL)PYRIMIDINE
Systematic Name English
Code System Code Type Description
CAS
213745-86-9
Created by admin on Sat Jun 26 09:07:00 UTC 2021 , Edited by admin on Sat Jun 26 09:07:00 UTC 2021
PRIMARY
PUBCHEM
44296584
Created by admin on Sat Jun 26 09:07:00 UTC 2021 , Edited by admin on Sat Jun 26 09:07:00 UTC 2021
PRIMARY
FDA UNII
G6AV6588UC
Created by admin on Sat Jun 26 09:07:00 UTC 2021 , Edited by admin on Sat Jun 26 09:07:00 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
UNSPECIFIED
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP