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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H32N4O2S
Molecular Weight 404.5713
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CQA-206-291

SMILES

CCn1cc2C[C@]3([H])[C@]([H])(C[C@@]([H])(CN3C)NS(=O)(=O)N(CC)CC)c4cccc1c24

InChI

InChIKey=ARTRTLXKTHJPRW-ILZDJORESA-N
InChI=1S/C21H32N4O2S/c1-5-24-13-15-11-20-18(17-9-8-10-19(24)21(15)17)12-16(14-23(20)4)22-28(26,27)25(6-2)7-3/h8-10,13,16,18,20,22H,5-7,11-12,14H2,1-4H3/t16-,18+,20+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H32N4O2S
Molecular Weight 404.5713
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 Sat Jun 26 16:11:26 UTC 2021
Edited
by admin
on Sat Jun 26 16:11:26 UTC 2021
Record UNII
9I4I0M95U7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CQA-206-291
Common Name English
N,N-DIETHYL-N'-((8.ALPHA.)-1-ETHYL-6-METHYLERGOLIN-8-YL)SULFAMIDE
Systematic Name English
SULFAMIDE, N,N-DIETHYL-N'-((8.ALPHA.)-1-ETHYL-6-METHYLERGOLIN-8-YL)-
Systematic Name English
CQA-206-291 FREE BASE
Code English
Code System Code Type Description
CAS
93822-42-5
Created by admin on Sat Jun 26 16:11:26 UTC 2021 , Edited by admin on Sat Jun 26 16:11:26 UTC 2021
PRIMARY
FDA UNII
9I4I0M95U7
Created by admin on Sat Jun 26 16:11:26 UTC 2021 , Edited by admin on Sat Jun 26 16:11:26 UTC 2021
PRIMARY
PUBCHEM
9953076
Created by admin on Sat Jun 26 16:11:26 UTC 2021 , Edited by admin on Sat Jun 26 16:11:26 UTC 2021
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
TARGET -> AGONIST
Related Record Type Details
ACTIVE MOIETY