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Details

Stereochemistry UNKNOWN
Molecular Formula C28H33N5O2S
Molecular Weight 503.659
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AZD-4877

SMILES

CC(C)C(N(CCCN)C(=O)C1=CC=C(C)C=C1)C2=NC3=C(C(C)=NS3)C(=O)N2CC4=CC=CC=C4

InChI

InChIKey=SMFXSYMLJDHGIE-UHFFFAOYSA-N
InChI=1S/C28H33N5O2S/c1-18(2)24(32(16-8-15-29)27(34)22-13-11-19(3)12-14-22)25-30-26-23(20(4)31-36-26)28(35)33(25)17-21-9-6-5-7-10-21/h5-7,9-14,18,24H,8,15-17,29H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C28H33N5O2S
Molecular Weight 503.659
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 00:36:45 UTC 2023
Edited
by admin
on Sat Dec 16 00:36:45 UTC 2023
Record UNII
19ORU63E06
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AZD-4877
Common Name English
N-(3-AMINOPROPYL)-N-(1-(5-BENZYL-3-METHYL-4-OXO-4,5-DIHYDROISOTHIAZOLO(5,4-D)PYRIMIDIN-6-YL)-2-METHYLPROPYL)-4-METHYLBENZAMIDE
Systematic Name English
AZD 4877 [WHO-DD]
Common Name English
AZD4877
Code English
Code System Code Type Description
FDA UNII
19ORU63E06
Created by admin on Sat Dec 16 00:36:45 UTC 2023 , Edited by admin on Sat Dec 16 00:36:45 UTC 2023
PRIMARY
EPA CompTox
DTXSID301026070
Created by admin on Sat Dec 16 00:36:45 UTC 2023 , Edited by admin on Sat Dec 16 00:36:45 UTC 2023
PRIMARY
NCI_THESAURUS
C64522
Created by admin on Sat Dec 16 00:36:45 UTC 2023 , Edited by admin on Sat Dec 16 00:36:45 UTC 2023
PRIMARY
PUBCHEM
10368812
Created by admin on Sat Dec 16 00:36:45 UTC 2023 , Edited by admin on Sat Dec 16 00:36:45 UTC 2023
PRIMARY
SMS_ID
100000175797
Created by admin on Sat Dec 16 00:36:45 UTC 2023 , Edited by admin on Sat Dec 16 00:36:45 UTC 2023
PRIMARY
DRUG BANK
DB11671
Created by admin on Sat Dec 16 00:36:45 UTC 2023 , Edited by admin on Sat Dec 16 00:36:45 UTC 2023
PRIMARY
CAS
1176760-49-8
Created by admin on Sat Dec 16 00:36:45 UTC 2023 , Edited by admin on Sat Dec 16 00:36:45 UTC 2023
PRIMARY
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