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Details

Stereochemistry ACHIRAL
Molecular Formula C25H34N4O2
Molecular Weight 421.5638
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of WAY-100635 CARBONYL-C-11

SMILES

COC1=C(C=CC=C1)N2CCN(CCN(C3=NC=CC=C3)[11C](=O)C4CCCCC4)CC2

InChI

InChIKey=SBPRIAGPYFYCRT-FNNGWQQSSA-N
InChI=1S/C25H34N4O2/c1-31-23-12-6-5-11-22(23)28-18-15-27(16-19-28)17-20-29(24-13-7-8-14-26-24)25(30)21-9-3-2-4-10-21/h5-8,11-14,21H,2-4,9-10,15-20H2,1H3/i25-1

HIDE SMILES / InChI

Molecular Formula C25H34N4O2
Molecular Weight 421.5638
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
DAV805YGOX
Record Status Validated (UNII)
Record Version