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Details

Stereochemistry RACEMIC
Molecular Formula C19H22N4O3
Molecular Weight 354.403
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ICLAPRIM

SMILES

COC1=CC(CC2=C(N)N=C(N)N=C2)=C3C=CC(OC3=C1OC)C4CC4

InChI

InChIKey=HWJPWWYTGBZDEG-UHFFFAOYSA-N
InChI=1S/C19H22N4O3/c1-24-15-8-11(7-12-9-22-19(21)23-18(12)20)13-5-6-14(10-3-4-10)26-16(13)17(15)25-2/h5-6,8-10,14H,3-4,7H2,1-2H3,(H4,20,21,22,23)

HIDE SMILES / InChI

Molecular Formula C19H22N4O3
Molecular Weight 354.403
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:35:24 UTC 2023
Edited
by admin
on Sat Dec 16 17:35:24 UTC 2023
Record UNII
42445HUU0O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ICLAPRIM
INN   MART.   MI   USAN   WHO-DD  
USAN   INN  
Official Name English
2,4-PYRIMIDINEDIAMINE, 5-((2-CYCLOPROPYL-7,8-DIMETHOXY-2H-1-BENZOPYRAN-5-YL)METHYL)-
Systematic Name English
ICLAPRIM [MART.]
Common Name English
RO-48-2622
Code English
AR-100.001
Code English
5-{[(2RS)-2-Cyclopropyl-7,8-dimethoxy-2H-1-benzopyran-5-yl]methyl}pyrimidine-2,4-diamine
Systematic Name English
Iclaprim [WHO-DD]
Common Name English
ICLAPRIM [USAN]
Common Name English
AR-100
Code English
iclaprim [INN]
Common Name English
RO 48-2622
Code English
ICLAPRIM [MI]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C258
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
WHO-ATC J01EA03
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
FDA ORPHAN DRUG 514415
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
WHO-VATC QJ01EA03
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
NCI_THESAURUS C2153
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
Code System Code Type Description
FDA UNII
42445HUU0O
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
PRIMARY
INN
8315
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
PRIMARY
EPA CompTox
DTXSID70870191
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
PRIMARY
ChEMBL
CHEMBL134561
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
PRIMARY
EVMPD
SUB32201
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
PRIMARY
DRUG CENTRAL
4573
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
PRIMARY
NCI_THESAURUS
C65877
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
PRIMARY
CAS
192314-93-5
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
PRIMARY
PUBCHEM
213043
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
PRIMARY
MERCK INDEX
m6196
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
PRIMARY Merck Index
USAN
UU-105
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
PRIMARY
DRUG BANK
DB06358
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
PRIMARY
SMS_ID
100000124368
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
PRIMARY
WIKIPEDIA
Iclaprim
Created by admin on Sat Dec 16 17:35:24 UTC 2023 , Edited by admin on Sat Dec 16 17:35:24 UTC 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
TARGET ORGANISM->INHIBITOR
ENANTIOMER -> RACEMATE
TARGET ORGANISM->INHIBITOR
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY