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Details

Stereochemistry RACEMIC
Molecular Formula C23H24F3N3OS.2ClH
Molecular Weight 520.438
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AZAFTOZINE DIHYDROCHLORIDE

SMILES

Cl.Cl.FC(F)(F)C1=CC=C2SC3=CC=CC=C3N(C(=O)CCN4CCN5CCCC5C4)C2=C1

InChI

InChIKey=GVGIKFHGXHADSJ-UHFFFAOYSA-N
InChI=1S/C23H24F3N3OS.2ClH/c24-23(25,26)16-7-8-21-19(14-16)29(18-5-1-2-6-20(18)31-21)22(30)9-11-27-12-13-28-10-3-4-17(28)15-27;;/h1-2,5-8,14,17H,3-4,9-13,15H2;2*1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
MOL RATIO 2 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C23H24F3N3OS
Molecular Weight 447.516
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
4E9DHZ1Y1K
Record Status Validated (UNII)
Record Version