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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H19N3O4S
Molecular Weight 397.448
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LY-171217

SMILES

CC1=C(N2[C@H](SC1)[C@H](NC(=O)[C@H](N)C3=CC=C4C=CC=CC4=C3)C2=O)C(O)=O

InChI

InChIKey=VQEWIGYVZJQQKA-SPYBWZPUSA-N
InChI=1S/C20H19N3O4S/c1-10-9-28-19-15(18(25)23(19)16(10)20(26)27)22-17(24)14(21)13-7-6-11-4-2-3-5-12(11)8-13/h2-8,14-15,19H,9,21H2,1H3,(H,22,24)(H,26,27)/t14-,15-,19-/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H19N3O4S
Molecular Weight 397.448
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 00:55:35 GMT 2025
Edited
by admin
on Wed Apr 02 00:55:35 GMT 2025
Record UNII
TIR0GPZ1NU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LY-171217
Code English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-(((2R)-AMINO-2-NAPHTHALENYLACETYL)AMINO)-3-METHYL-8-OXO-, (6R,7R)-
Preferred Name English
Code System Code Type Description
FDA UNII
TIR0GPZ1NU
Created by admin on Wed Apr 02 00:55:35 GMT 2025 , Edited by admin on Wed Apr 02 00:55:35 GMT 2025
PRIMARY
CAS
93662-89-6
Created by admin on Wed Apr 02 00:55:35 GMT 2025 , Edited by admin on Wed Apr 02 00:55:35 GMT 2025
PRIMARY
PUBCHEM
13339667
Created by admin on Wed Apr 02 00:55:35 GMT 2025 , Edited by admin on Wed Apr 02 00:55:35 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY