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Details

Stereochemistry ACHIRAL
Molecular Formula C24H24FN5OS.ClH
Molecular Weight 486.005
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NNI-351 hydrochloride

SMILES

Cl.CCOC1=CC=C2N=C(N3CCCN(CC3)C(=S)NC4=C(F)C=CC=C4)C(=CC2=C1)C#N

InChI

InChIKey=DPOQYENNSSJHTJ-UHFFFAOYSA-N
InChI=1S/C24H24FN5OS.ClH/c1-2-31-19-8-9-21-17(15-19)14-18(16-26)23(27-21)29-10-5-11-30(13-12-29)24(32)28-22-7-4-3-6-20(22)25;/h3-4,6-9,14-15H,2,5,10-13H2,1H3,(H,28,32);1H

HIDE SMILES / InChI

Molecular Formula C24H24FN5OS
Molecular Weight 449.544
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

Molecular Formula ClH
Molecular Weight 36.461
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
HN3S2R929C
Record Status Validated (UNII)
Record Version