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

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H30F6N2O2
Molecular Weight 528.5297
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (5.ALPHA.,17.ALPHA.)-N-(2,5-BIS(TRIFLUOROMETHYL)PHENYL)-3-OXO-4-AZAANDROST-1-ENE-17-CARBOXAMIDE

SMILES

[H][C@@]12CC[C@@H](C(=O)NC3=CC(=CC=C3C(F)(F)F)C(F)(F)F)[C@@]1(C)CC[C@@]4([H])[C@@]2([H])CC[C@@]5([H])NC(=O)C=C[C@]45C

InChI

InChIKey=JWJOTENAMICLJG-UWKVNAJESA-N
InChI=1S/C27H30F6N2O2/c1-24-11-9-17-15(4-8-21-25(17,2)12-10-22(36)35-21)16(24)6-7-19(24)23(37)34-20-13-14(26(28,29)30)3-5-18(20)27(31,32)33/h3,5,10,12-13,15-17,19,21H,4,6-9,11H2,1-2H3,(H,34,37)(H,35,36)/t15-,16-,17-,19-,21+,24-,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H30F6N2O2
Molecular Weight 528.5297
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 07:52:20 GMT 2023
Edited
by admin
on Sat Dec 16 07:52:20 GMT 2023
Record UNII
6S8DGN8P3M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(5.ALPHA.,17.ALPHA.)-N-(2,5-BIS(TRIFLUOROMETHYL)PHENYL)-3-OXO-4-AZAANDROST-1-ENE-17-CARBOXAMIDE
Common Name English
1H-INDENO(5,4-F)QUINOLINE-7-CARBOXAMIDE, N-(2,5-BIS(TRIFLUOROMETHYL)PHENYL)-2,4A,4B,5,6,6A,7,8,9,9A,9B,10,11,11A-TETRADECAHYDRO-4A,6A-DIMETHYL-2-OXO-, (4AR,4BS,6AS,7R,9AS,9BS,11AR)-
Systematic Name English
N-(2,5-BIS(TRIFLUOROMETHYL)PHENYL)-3-OXO-4-AZA-5.ALPHA.-ANDROST-1-ENE-17.ALPHA.-CARBOXAMIDE
Systematic Name English
DUTASTERIDE IMPURITY E [EP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
124406546
Created by admin on Sat Dec 16 07:52:20 GMT 2023 , Edited by admin on Sat Dec 16 07:52:20 GMT 2023
PRIMARY
FDA UNII
6S8DGN8P3M
Created by admin on Sat Dec 16 07:52:20 GMT 2023 , Edited by admin on Sat Dec 16 07:52:20 GMT 2023
PRIMARY
CAS
2102935-76-0
Created by admin on Sat Dec 16 07:52:20 GMT 2023 , Edited by admin on Sat Dec 16 07:52:20 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP