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

Details

Stereochemistry ACHIRAL
Molecular Formula C25H21N5O3S
Molecular Weight 471.531
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MK-8033

SMILES

CN1C=C(C=N1)C2=CN=C3C=CC4=CC=C(CS(=O)(=O)NCC5=NC=CC=C5)C=C4C(=O)C3=C2

InChI

InChIKey=VMJFTOSOFDEKTM-UHFFFAOYSA-N
InChI=1S/C25H21N5O3S/c1-30-15-20(13-28-30)19-11-23-24(27-12-19)8-7-18-6-5-17(10-22(18)25(23)31)16-34(32,33)29-14-21-4-2-3-9-26-21/h2-13,15,29H,14,16H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
MK-8033
Common Name English
MK8033
Code English
5H-BENZO(4,5)CYCLOHEPTA(1,2-B)PYRIDINE-7-METHANESULFONAMIDE, 3-(1-METHYL-1H-PYRAZOL-4-YL)-5-OXO-N-(2-PYRIDINYLMETHYL)-
Systematic Name English
1-(3-(1-METHYL-1H-PYRAZOL-4-YL)-5-OXO-5H-BENZO(4,5)CYCLOHEPTA(1,2-B)PYRIDIN-7-YL)-N-(PYRIDIN-2-YLMETHYL)METHANESULFONAMIDE
Systematic Name English
Code System Code Type Description
NCI_THESAURUS
C116866
Created by admin on Sat Dec 16 08:12:32 UTC 2023 , Edited by admin on Sat Dec 16 08:12:32 UTC 2023
PRIMARY
FDA UNII
350H6PBQ5Q
Created by admin on Sat Dec 16 08:12:32 UTC 2023 , Edited by admin on Sat Dec 16 08:12:32 UTC 2023
PRIMARY
EPA CompTox
DTXSID00143002
Created by admin on Sat Dec 16 08:12:32 UTC 2023 , Edited by admin on Sat Dec 16 08:12:32 UTC 2023
PRIMARY
CAS
1196681-38-5
Created by admin on Sat Dec 16 08:12:32 UTC 2023 , Edited by admin on Sat Dec 16 08:12:32 UTC 2023
NO STRUCTURE GIVEN
EVMPD
SUB184497
Created by admin on Sat Dec 16 08:12:32 UTC 2023 , Edited by admin on Sat Dec 16 08:12:32 UTC 2023
PRIMARY
CAS
1001917-37-8
Created by admin on Sat Dec 16 08:12:32 UTC 2023 , Edited by admin on Sat Dec 16 08:12:32 UTC 2023
PRIMARY
PUBCHEM
45142457
Created by admin on Sat Dec 16 08:12:32 UTC 2023 , Edited by admin on Sat Dec 16 08:12:32 UTC 2023
PRIMARY
SMS_ID
100000170503
Created by admin on Sat Dec 16 08:12:32 UTC 2023 , Edited by admin on Sat Dec 16 08:12:32 UTC 2023
PRIMARY
ChEMBL
CHEMBL2323775
Created by admin on Sat Dec 16 08:12:32 UTC 2023 , Edited by admin on Sat Dec 16 08:12:32 UTC 2023
PRIMARY