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Details

Stereochemistry ACHIRAL
Molecular Formula C21H28N6O4S
Molecular Weight 460.55
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PYRAZOLE N-DEMETHYL SILDENAFIL

SMILES

CCCC1=NNC2=C1NC(=NC2=O)C3=C(OCC)C=CC(=C3)S(=O)(=O)N4CCN(C)CC4

InChI

InChIKey=ZLJVUHMTFSCAGQ-UHFFFAOYSA-N
InChI=1S/C21H28N6O4S/c1-4-6-16-18-19(25-24-16)21(28)23-20(22-18)15-13-14(7-8-17(15)31-5-2)32(29,30)27-11-9-26(3)10-12-27/h7-8,13H,4-6,9-12H2,1-3H3,(H,24,25)(H,22,23,28)

HIDE SMILES / InChI

Molecular Formula C21H28N6O4S
Molecular Weight 460.55
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 10:41:30 GMT 2023
Edited
by admin
on Sat Dec 16 10:41:30 GMT 2023
Record UNII
P1243M9SVH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PYRAZOLE N-DEMETHYL SILDENAFIL
Common Name English
5-(2-ETHOXY-5-(4-METHYLPIPERAZIN-1-YLSULFONYL)PHENYL)-3-PROPYL-1,6-DIHYDRO-7H-PYRAZOLO(4,3-D)PYRIMIDIN-7-ONE
Systematic Name English
7H-PYRAZOLO(4,3-D)PYRIMIDIN-7-ONE, 5-(2-ETHOXY-5-((4-METHYL-1-PIPERAZINYL)SULFONYL)PHENYL)-1,6-DIHYDRO-3-PROPYL-
Systematic Name English
PIPERAZINE, 1-((3-(4,7-DIHYDROXY-7-OXO-3-PROPYL-1H-PYRAZOLO(4,3-D)PYRIMIDIN-5-YL)-4-ETHOXYPHENYL)SULFONYL)-4-METHYL-
Systematic Name English
5-(2-ETHOXY-5-((4-METHYL-1-PIPERAZINYL)SULFONYL)PHENYL)-1,6-DIHYDRO-3-PROPYL-7H-PYRAZOLO(4,3-D)PYRIMIDIN-7-ONE
Systematic Name English
Code System Code Type Description
FDA UNII
P1243M9SVH
Created by admin on Sat Dec 16 10:41:30 GMT 2023 , Edited by admin on Sat Dec 16 10:41:30 GMT 2023
PRIMARY
CAS
139755-95-6
Created by admin on Sat Dec 16 10:41:30 GMT 2023 , Edited by admin on Sat Dec 16 10:41:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID00435176
Created by admin on Sat Dec 16 10:41:30 GMT 2023 , Edited by admin on Sat Dec 16 10:41:30 GMT 2023
PRIMARY
PUBCHEM
135543792
Created by admin on Sat Dec 16 10:41:30 GMT 2023 , Edited by admin on Sat Dec 16 10:41:30 GMT 2023
PRIMARY