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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H20N4O3
Molecular Weight 352.3871
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LY-300168, (R)-

SMILES

CNC(=O)N1N=C(C2=CC=C(N)C=C2)C3=CC4=C(OCO4)C=C3C[C@H]1C

InChI

InChIKey=SMGACXZFVXKEAX-LLVKDONJSA-N
InChI=1S/C19H20N4O3/c1-11-7-13-8-16-17(26-10-25-16)9-15(13)18(22-23(11)19(24)21-2)12-3-5-14(20)6-4-12/h3-6,8-9,11H,7,10,20H2,1-2H3,(H,21,24)/t11-/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H20N4O3
Molecular Weight 352.3871
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:37:55 GMT 2023
Edited
by admin
on Sat Dec 16 11:37:55 GMT 2023
Record UNII
91N8O25H4L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LY-300168, (R)-
Common Name English
LY-303070
Code English
GYKI 53784
Code English
LY 303070
Code English
GYKI-53784
Code English
7H-1,3-DIOXOLO(4,5-H)(2,3)BENZODIAZEPINE-7-CARBOXAMIDE, 5-(4-AMINOPHENYL)-8,9-DIHYDRO-N,8-DIMETHYL-, (8R)-
Systematic Name English
(-)-1-(4-AMINOPHENYL)-3-METHYLCARBAMOYL-4-METHYL-7,8-METHYLENEDIOXY-3,4-DIHYDRO-5H-2,3-BENZODIAZEPINE
Systematic Name English
LY-300168, (-)-
Common Name English
Code System Code Type Description
CAS
161832-71-9
Created by admin on Sat Dec 16 11:37:55 GMT 2023 , Edited by admin on Sat Dec 16 11:37:55 GMT 2023
PRIMARY
EPA CompTox
DTXSID20167260
Created by admin on Sat Dec 16 11:37:55 GMT 2023 , Edited by admin on Sat Dec 16 11:37:55 GMT 2023
PRIMARY
FDA UNII
91N8O25H4L
Created by admin on Sat Dec 16 11:37:55 GMT 2023 , Edited by admin on Sat Dec 16 11:37:55 GMT 2023
PRIMARY
PUBCHEM
3074805
Created by admin on Sat Dec 16 11:37:55 GMT 2023 , Edited by admin on Sat Dec 16 11:37:55 GMT 2023
PRIMARY