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Details

Stereochemistry ACHIRAL
Molecular Formula C24H32N6O3
Molecular Weight 452.5493
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CARBODENAFIL

SMILES

CCCC1=NN(C)C2=C1NC(=NC2=O)C3=C(OCC)C=CC(=C3)C(=O)N4CCN(CC)CC4

InChI

InChIKey=BNQTXDVBJLRWNB-UHFFFAOYSA-N
InChI=1S/C24H32N6O3/c1-5-8-18-20-21(28(4)27-18)23(31)26-22(25-20)17-15-16(9-10-19(17)33-7-3)24(32)30-13-11-29(6-2)12-14-30/h9-10,15H,5-8,11-14H2,1-4H3,(H,25,26,31)

HIDE SMILES / InChI

Molecular Formula C24H32N6O3
Molecular Weight 452.5493
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:25:46 UTC 2023
Edited
by admin
on Sat Dec 16 11:25:46 UTC 2023
Record UNII
71OOU63R8M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CARBODENAFIL
Common Name English
7H-PYRAZOLO(4,3-D)PYRIMIDIN-7-ONE, 5-(2-ETHOXY-5-((4-ETHYL-1-PIPERAZINYL)CARBONYL)PHENYL)-1,6-DIHYDRO-1-METHYL-3-PROPYL-
Systematic Name English
FONDENAFIL
Common Name English
5-(2-ETHOXY-5-((4-ETHYL-1-PIPERAZINYL)CARBONYL)PHENYL)-1,6-DIHYDRO-1-METHYL-3-PROPYL-7H-PYRAZOLO(4,3-D)PYRIMIDIN-7-ONE
Systematic Name English
Code System Code Type Description
CAS
944241-52-5
Created by admin on Sat Dec 16 11:25:46 UTC 2023 , Edited by admin on Sat Dec 16 11:25:46 UTC 2023
PRIMARY
EPA CompTox
DTXSID00747822
Created by admin on Sat Dec 16 11:25:46 UTC 2023 , Edited by admin on Sat Dec 16 11:25:46 UTC 2023
PRIMARY
PUBCHEM
135564767
Created by admin on Sat Dec 16 11:25:46 UTC 2023 , Edited by admin on Sat Dec 16 11:25:46 UTC 2023
PRIMARY
FDA UNII
71OOU63R8M
Created by admin on Sat Dec 16 11:25:46 UTC 2023 , Edited by admin on Sat Dec 16 11:25:46 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY