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

Details

Stereochemistry MIXED
Molecular Formula C35H55NO3
Molecular Weight 537.8161
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NABAZENIL

SMILES

CCCCCC(C)C(C)C1=CC2=C(C(OC(=O)CCCN3CCCCCC3)=C1)C4=C(CCC(C)C4)C(C)(C)O2

InChI

InChIKey=DRVZFWZGQKGHQO-UHFFFAOYSA-N
InChI=1S/C35H55NO3/c1-7-8-11-15-26(3)27(4)28-23-31(38-33(37)16-14-21-36-19-12-9-10-13-20-36)34-29-22-25(2)17-18-30(29)35(5,6)39-32(34)24-28/h23-27H,7-22H2,1-6H3

HIDE SMILES / InChI

Molecular Formula C35H55NO3
Molecular Weight 537.8161
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

PubMed

PubMed

TitleDatePubMed
Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:40:51 GMT 2023
Edited
by admin
on Fri Dec 15 15:40:51 GMT 2023
Record UNII
N1RX70K36C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NABAZENIL
INN   USAN  
USAN   INN  
Official Name English
NABAZENIL [USAN]
Common Name English
3-(1,2-Dimethylheptyl)-7,8,9,10-tetrahydro-6,6,9-trimethyl-6H-dibenzo[b,d]pyran-1-yl hexahydro-1H-azepine-1-butyrate
Systematic Name English
nabazenil [INN]
Common Name English
SP-175
Code English
1H-AZEPINE-1-BUTANOIC ACID, HEXAHYDRO-, 3-(1,2-DIMETHYLHEPTYL)-7,8,9,10-TETRAHYDRO-6,6,9-TRIMETHYL-6H-DIBENZO(B,D)PYRAN-1-YL ESTER
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C1012
Created by admin on Fri Dec 15 15:40:52 GMT 2023 , Edited by admin on Fri Dec 15 15:40:52 GMT 2023
NCI_THESAURUS C264
Created by admin on Fri Dec 15 15:40:52 GMT 2023 , Edited by admin on Fri Dec 15 15:40:52 GMT 2023
Code System Code Type Description
USAN
T-92
Created by admin on Fri Dec 15 15:40:52 GMT 2023 , Edited by admin on Fri Dec 15 15:40:52 GMT 2023
PRIMARY
CAS
58019-65-1
Created by admin on Fri Dec 15 15:40:52 GMT 2023 , Edited by admin on Fri Dec 15 15:40:52 GMT 2023
PRIMARY
ChEMBL
CHEMBL2107661
Created by admin on Fri Dec 15 15:40:52 GMT 2023 , Edited by admin on Fri Dec 15 15:40:52 GMT 2023
PRIMARY
NCI_THESAURUS
C96724
Created by admin on Fri Dec 15 15:40:52 GMT 2023 , Edited by admin on Fri Dec 15 15:40:52 GMT 2023
PRIMARY
INN
5331
Created by admin on Fri Dec 15 15:40:52 GMT 2023 , Edited by admin on Fri Dec 15 15:40:52 GMT 2023
PRIMARY
PUBCHEM
163326
Created by admin on Fri Dec 15 15:40:52 GMT 2023 , Edited by admin on Fri Dec 15 15:40:52 GMT 2023
PRIMARY
SMS_ID
100000084405
Created by admin on Fri Dec 15 15:40:52 GMT 2023 , Edited by admin on Fri Dec 15 15:40:52 GMT 2023
PRIMARY
FDA UNII
N1RX70K36C
Created by admin on Fri Dec 15 15:40:52 GMT 2023 , Edited by admin on Fri Dec 15 15:40:52 GMT 2023
PRIMARY
WIKIPEDIA
NABAZENIL
Created by admin on Fri Dec 15 15:40:52 GMT 2023 , Edited by admin on Fri Dec 15 15:40:52 GMT 2023
PRIMARY
EVMPD
SUB09103MIG
Created by admin on Fri Dec 15 15:40:52 GMT 2023 , Edited by admin on Fri Dec 15 15:40:52 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY