U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry ACHIRAL
Molecular Formula C25H34N6O3S
Molecular Weight 498.641
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HYDROXYTHIO ACETILDENAFIL

SMILES

CCCC1=NN(C)C2=C1NC(=NC2=S)C3=CC(=CC=C3OCC)C(=O)CN4CCN(CCO)CC4

InChI

InChIKey=GOXVEZHZFNNJSU-UHFFFAOYSA-N
InChI=1S/C25H34N6O3S/c1-4-6-19-22-23(29(3)28-19)25(35)27-24(26-22)18-15-17(7-8-21(18)34-5-2)20(33)16-31-11-9-30(10-12-31)13-14-32/h7-8,15,32H,4-6,9-14,16H2,1-3H3,(H,26,27,35)

HIDE SMILES / InChI

Molecular Formula C25H34N6O3S
Molecular Weight 498.641
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
YDB0512633
Record Status Validated (UNII)
Record Version