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Details

Stereochemistry ACHIRAL
Molecular Formula C28H34N6O4S
Molecular Weight 550.672
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-DESMETHYL-N-BENZYL SILDENAFIL

SMILES

CCCC1=NN(C)C2=C1NC(=NC2=O)C3=C(OCC)C=CC(=C3)S(=O)(=O)N4CCN(CC5=CC=CC=C5)CC4

InChI

InChIKey=ZNBBYJQSWODKSY-UHFFFAOYSA-N
InChI=1S/C28H34N6O4S/c1-4-9-23-25-26(32(3)31-23)28(35)30-27(29-25)22-18-21(12-13-24(22)38-5-2)39(36,37)34-16-14-33(15-17-34)19-20-10-7-6-8-11-20/h6-8,10-13,18H,4-5,9,14-17,19H2,1-3H3,(H,29,30,35)

HIDE SMILES / InChI

Molecular Formula C28H34N6O4S
Molecular Weight 550.672
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 10:41:31 UTC 2023
Edited
by admin
on Sat Dec 16 10:41:31 UTC 2023
Record UNII
KV84GB3NEM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-DESMETHYL-N-BENZYL SILDENAFIL
Common Name English
5-(2-ETHOXY-5-((4-(PHENYLMETHYL)-1-PIPERAZINYL)SULFONYL)PHENYL)-1,6-DIHYDRO-1-METHYL-3-PROPYL-7H-PYRAZOLO(4,3-D)PYRIMIDIN-7-ONE
Systematic Name English
7H-PYRAZOLO(4,3-D)PYRIMIDIN-7-ONE, 5-(2-ETHOXY-5-((4-(PHENYLMETHYL)-1-PIPERAZINYL)SULFONYL)PHENYL)-1,6-DIHYDRO-1-METHYL-3-PROPYL-
Systematic Name English
BENZYLSILDENAFIL
Common Name English
Code System Code Type Description
PUBCHEM
135564565
Created by admin on Sat Dec 16 10:41:31 UTC 2023 , Edited by admin on Sat Dec 16 10:41:31 UTC 2023
PRIMARY
CAS
1446089-82-2
Created by admin on Sat Dec 16 10:41:31 UTC 2023 , Edited by admin on Sat Dec 16 10:41:31 UTC 2023
PRIMARY
FDA UNII
KV84GB3NEM
Created by admin on Sat Dec 16 10:41:31 UTC 2023 , Edited by admin on Sat Dec 16 10:41:31 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR