U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C17H20N4O5S
Molecular Weight 392.429
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(1,4-DIHYDRO-5-METHYL-4-OXO-7-PROPYLIMIDAZO(5,1-F)(1,2,4)TRIAZIN-2-YL)-4-ETHOXYBENZENESULFONIC ACID

SMILES

CCCC1=NC(C)=C2N1N=C(NC2=O)C3=CC(=CC=C3OCC)S(O)(=O)=O

InChI

InChIKey=XTMCEBZOWCIYQF-UHFFFAOYSA-N
InChI=1S/C17H20N4O5S/c1-4-6-14-18-10(3)15-17(22)19-16(20-21(14)15)12-9-11(27(23,24)25)7-8-13(12)26-5-2/h7-9H,4-6H2,1-3H3,(H,19,20,22)(H,23,24,25)

HIDE SMILES / InChI

Molecular Formula C17H20N4O5S
Molecular Weight 392.429
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 11:49:33 UTC 2023
Edited
by admin
on Sat Dec 16 11:49:33 UTC 2023
Record UNII
2XL0MEO2MW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(1,4-DIHYDRO-5-METHYL-4-OXO-7-PROPYLIMIDAZO(5,1-F)(1,2,4)TRIAZIN-2-YL)-4-ETHOXYBENZENESULFONIC ACID
Systematic Name English
4-ETHOXY-3-(5-METHYL-4-OXO-7-PROPYL-3,4-DIHYDROIMIDAZO(5,1-F)(1,2,4)TRIAZIN-2-YL)BENZENESULFONIC ACID
Systematic Name English
BENZENESULFONIC ACID, 3-(1,4-DIHYDRO-5-METHYL-4-OXO-7-PROPYLIMIDAZO(5,1-F)(1,2,4)TRIAZIN-2-YL)-4-ETHOXY-
Systematic Name English
VARDENAFIL ACID
Common Name English
VARDENAFIL HYDROCHLORIDE TRIHYDRATE IMPURITY B [EP IMPURITY]
Common Name English
VARDENAFIL ACID [USP IMPURITY]
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID401036274
Created by admin on Sat Dec 16 11:49:34 UTC 2023 , Edited by admin on Sat Dec 16 11:49:34 UTC 2023
PRIMARY
CAS
437717-43-6
Created by admin on Sat Dec 16 11:49:34 UTC 2023 , Edited by admin on Sat Dec 16 11:49:34 UTC 2023
PRIMARY
PUBCHEM
135483690
Created by admin on Sat Dec 16 11:49:34 UTC 2023 , Edited by admin on Sat Dec 16 11:49:34 UTC 2023
PRIMARY
FDA UNII
2XL0MEO2MW
Created by admin on Sat Dec 16 11:49:34 UTC 2023 , Edited by admin on Sat Dec 16 11:49:34 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP