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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H20N2O3S
Molecular Weight 357.445
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEUTEROPIOGLITAZONE, (R)-

SMILES

[2H][C@]3(CC1=CC=C(OCCC2=CC=C(CC)C=N2)C=C1)SC(=O)NC3=O

InChI

InChIKey=HYAFETHFCAUJAY-VHLRUQIKSA-N
InChI=1S/C19H20N2O3S/c1-2-13-3-6-15(20-12-13)9-10-24-16-7-4-14(5-8-16)11-17-18(22)21-19(23)25-17/h3-8,12,17H,2,9-11H2,1H3,(H,21,22,23)/t17-/m1/s1/i17D

HIDE SMILES / InChI

Molecular Formula C19H20N2O3S
Molecular Weight 357.445
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
RQ8IV9N7OT
Record Status Validated (UNII)
Record Version