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Details

Stereochemistry ACHIRAL
Molecular Formula C27H29ClFN5O2
Molecular Weight 510.003
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(4-(3-CHLORO-4-FLUOROPHENYLAMINO)-7-((7-METHYL-7-AZASPIRO(3.5)NONAN-2-YL)METHOXY)QUINAZOLIN-6-YL)ACRYLAMIDE

SMILES

CN1CCC2(CC(COC3=C(NC(=O)C=C)C=C4C(NC5=CC(Cl)=C(F)C=C5)=NC=NC4=C3)C2)CC1

InChI

InChIKey=KJBZQIKLKWQVLL-UHFFFAOYSA-N
InChI=1S/C27H29ClFN5O2/c1-3-25(35)33-23-11-19-22(30-16-31-26(19)32-18-4-5-21(29)20(28)10-18)12-24(23)36-15-17-13-27(14-17)6-8-34(2)9-7-27/h3-5,10-12,16-17H,1,6-9,13-15H2,2H3,(H,33,35)(H,30,31,32)

HIDE SMILES / InChI
Molecular Formula C27H29ClFN5O2
Molecular Weight 510.003
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

Unknown
149,124
Substance Class Chemical
Record UNII
M8R6ETA52F
Record Status Validated (UNII)
Record Version
NIH
NCATS
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