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Details

Stereochemistry ACHIRAL
Molecular Formula C23H26N8O3
Molecular Weight 462.5043
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ABSK-012

SMILES

CN(C(=O)NC1=NC=C(C#N)C(NC2CC2)=C1)C3=NC(C=O)=C(CN4CCN(C)CC4=O)C=C3

InChI

InChIKey=MXHSTECIDQMETN-UHFFFAOYSA-N
InChI=1S/C23H26N8O3/c1-29-7-8-31(22(33)13-29)12-15-3-6-21(27-19(15)14-32)30(2)23(34)28-20-9-18(26-17-4-5-17)16(10-24)11-25-20/h3,6,9,11,14,17H,4-5,7-8,12-13H2,1-2H3,(H2,25,26,28,34)

HIDE SMILES / InChI

Molecular Formula C23H26N8O3
Molecular Weight 462.5043
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
8XDP7T5XLU
Record Status Validated (UNII)
Record Version