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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H25N5O5S
Molecular Weight 495.551
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MK-2461

SMILES

CN(C[C@@H]1COCCO1)S(=O)(=O)NC2=CC=C3C=CC4=NC=C(C=C4C(=O)C3=C2)C5=CN(C)N=C5

InChI

InChIKey=JGEBLDKNWBUGRZ-HXUWFJFHSA-N
InChI=1S/C24H25N5O5S/c1-28-13-18(12-26-28)17-9-22-23(25-11-17)6-4-16-3-5-19(10-21(16)24(22)30)27-35(31,32)29(2)14-20-15-33-7-8-34-20/h3-6,9-13,20,27H,7-8,14-15H2,1-2H3/t20-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
MK-2461
Common Name English
SULFAMIDE, N-((2R)-1,4-DIOXAN-2-YLMETHYL)-N-METHYL-N'-(3-(1-METHYL-1H-PYRAZOL-4-YL)-5-OXO-5H-BENZO(4,5)CYCLOHEPTA(1,2-B)PYRIDIN-7-YL)-
Systematic Name English
Code System Code Type Description
ChEMBL
CHEMBL1822792
Created by admin on Sat Dec 16 08:05:15 UTC 2023 , Edited by admin on Sat Dec 16 08:05:15 UTC 2023
PRIMARY
EPA CompTox
DTXSID701025862
Created by admin on Sat Dec 16 08:05:15 UTC 2023 , Edited by admin on Sat Dec 16 08:05:15 UTC 2023
PRIMARY
CAS
917879-39-1
Created by admin on Sat Dec 16 08:05:15 UTC 2023 , Edited by admin on Sat Dec 16 08:05:15 UTC 2023
PRIMARY
PUBCHEM
44137946
Created by admin on Sat Dec 16 08:05:15 UTC 2023 , Edited by admin on Sat Dec 16 08:05:15 UTC 2023
PRIMARY
FDA UNII
4200RD53XF
Created by admin on Sat Dec 16 08:05:15 UTC 2023 , Edited by admin on Sat Dec 16 08:05:15 UTC 2023
PRIMARY