Basic Searches
Searches without any special characters (listed below) will return items that contain the exact value(s) entered in the search field. This means that searching for "ASPIRIN CALCIUM" won't return any items that have "ASPIRIN GLYCINE CALCIUM" because the search term doesn't match exactly.
Boolean Operators
OR - searches with terms separated by " OR " will return items that contain any of the terms in the search.
Example: "ASPIRIN" OR "CALCIUM" will return items that have strings like "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because they contain at least one of the terms in the search.

AND - searches with terms separated by " AND " will return items that contain all the terms in the search.
Example: "ASPIRIN" AND "CALCIUM" won't return items that have strings "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because neither contain both terms, but it will return "ASPIRIN GLYCINE CALCIUM" because it contains both search terms.
version 2.7.1
Substance Class Chemical
Record UNII
1487U1Q3IQ
Record Status Validated
Record Version
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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H19N3O2
Molecular Weight 297.3517
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0
Created by admin on Wed Aug 04 01:58:17 EDT 2021
Edited by admin on Wed Aug 04 01:58:17 EDT 2021
Structure of ELSUBRUTINIB

Systematic Names:

  • None recorded

SMILES

NC(=O)C1=C2NC=CC2=C(C=C1)[C@@H]3CCCN(C3)C(=O)C=C

InChI

UNHZLHSLZZWMNP-LLVKDONJSA-N
InChI=1S/C17H19N3O2/c1-2-15(21)20-9-3-4-11(10-20)12-5-6-14(17(18)22)16-13(12)7-8-19-16/h2,5-8,11,19H,1,3-4,9-10H2,(H2,18,22)/t11-/m1/s1
Name Type Language Details Access References
ELSUBRUTINIB
Domain Jurisdiction Naming Organization
drug  
USAN   INN  
Official Name
English  
ELSUBRUTINIB [USAN]
Common Name
English  
ELSUBRUTINIB [INN]
Common Name
English  
ABBV105
Code
English  
4-((3S)-1-(PROP-2-ENOYL)-PIPERIDIN-3-YL)-1H-INDOLE-7-CARBOXAMIDE
Systematic Name
English  
1H-INDOLE-7-CARBOXAMIDE, 4-((3S)-1-(1-OXO-2-PROPEN-1-YL)-3-PIPERIDINYL)-
Systematic Name
English  
(S)-4-(1-ACRYLOYLPIPERIDIN-3-YL)-1H-INDOLE-7-CARBOXAMIDE
Systematic Name
English  
Code System Code Type Description Access References
CAS
1953227-31-0
Created by admin on Wed Aug 04 01:58:17 EDT 2021 , Edited by admin on Wed Aug 04 01:58:17 EDT 2021
NO STRUCTURE GIVEN
CAS
1643570-24-4
Created by admin on Wed Aug 04 01:58:17 EDT 2021 , Edited by admin on Wed Aug 04 01:58:17 EDT 2021
PRIMARY
FDA UNII
1487U1Q3IQ
Created by admin on Wed Aug 04 01:58:17 EDT 2021 , Edited by admin on Wed Aug 04 01:58:17 EDT 2021
PRIMARY
INN
11113
Created by admin on Wed Aug 04 01:58:17 EDT 2021 , Edited by admin on Wed Aug 04 01:58:17 EDT 2021
PRIMARY
NCI_THESAURUS
C175777
Created by admin on Wed Aug 04 01:58:17 EDT 2021 , Edited by admin on Wed Aug 04 01:58:17 EDT 2021
PRIMARY
PUBCHEM
117773770
Created by admin on Wed Aug 04 01:58:17 EDT 2021 , Edited by admin on Wed Aug 04 01:58:17 EDT 2021
PRIMARY
Related Record Type Details Access References
TARGET -> INHIBITOR
Mediator Substance Details
none
IRREVERSIBLE INHIBITOR
Created by admin on Wed Aug 04 01:58:17 EDT 2021 , Edited by admin on Wed Aug 04 01:58:17 EDT 2021
Related Record Type Details Access References
ACTIVE MOIETY
none
none
Mediator Substance Details
none
Created by admin on Wed Aug 04 01:58:17 EDT 2021 , Edited by admin on Wed Aug 04 01:58:17 EDT 2021
Created Wed Aug 04 01:58:17 EDT 2021
Created By admin
Last Edited Wed Aug 04 01:58:17 EDT 2021
Last Edited By admin
Index Source Text / Citation Source Type Tags Date Accessed File Access
1 SRS CODE IMPORT SRS NOMEN Fri Apr 28 15:42:30 EDT 2017
2 SRS import [1487U1Q3IQ] SRS NOMEN Fri Apr 28 15:42:30 EDT 2017
3 STN STN (SCIFINDER)
4 SRS SRS NOMEN
5 USAN COUN 2021 USANCOUN PUBLIC_DOMAIN_RELEASE
6 PUBCHEM PUBCHEM NOMEN PUBLIC_DOMAIN_RELEASE
7 PETER NORMAN (2016) INVESTIGATIONAL BRUTON?S TYROSINE KINASE INHIBITORS FOR\\nTHE TREATMENT OF RHEUMATOID ARTHRITIS, EXPERT OPINION ON INVESTIGATIONAL DRUGS, 25:8, 891-899, DOI:\\n10.1080/13543784.2016.1182499 JOURNAL ARTICLE NOMEN
8 dump-public-2021-07-22_UPDATED.gsrs BATCH_IMPORT Wed Aug 04 01:58:16 EDT 2021
9 NCI THESAURUS
10 INN Proposed List 121 INN_LIST PUBLIC_DOMAIN_RELEASE
11 STN STN (SCIFINDER) PUBLIC_DOMAIN_RELEASE NOMEN

Molecular Formula C17H19N3O2
Molecular Weight 297.3517
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED