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Details

Stereochemistry ACHIRAL
Molecular Formula C25H24N3S
Molecular Weight 398.543
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of AA-1 CATION

SMILES

CN(C)C1=CC=C(C=C1)C2=CC(=[S+]C(=C2)C3=CC=C(N)C=C3)C4=CC=C(N)C=C4

InChI

InChIKey=PBKZKXFZFGWMOD-UHFFFAOYSA-N
InChI=1S/C25H24N3S/c1-28(2)23-13-7-17(8-14-23)20-15-24(18-3-9-21(26)10-4-18)29-25(16-20)19-5-11-22(27)12-6-19/h3-16H,26-27H2,1-2H3/q+1

HIDE SMILES / InChI

Molecular Formula C25H24N3S
Molecular Weight 398.543
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:57:41 GMT 2023
Edited
by admin
on Sat Dec 16 10:57:41 GMT 2023
Record UNII
52UXI5SZHT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AA-1 CATION
Common Name English
THIOPYRYLIUM, 2,6-BIS(4-AMINOPHENYL)-4-(4-(DIMETHYLAMINO)PHENYL)-
Systematic Name English
AA-001 CATION
Code English
Code System Code Type Description
CAS
126172-95-0
Created by admin on Sat Dec 16 10:57:41 GMT 2023 , Edited by admin on Sat Dec 16 10:57:41 GMT 2023
PRIMARY
PUBCHEM
130858
Created by admin on Sat Dec 16 10:57:41 GMT 2023 , Edited by admin on Sat Dec 16 10:57:41 GMT 2023
PRIMARY
FDA UNII
52UXI5SZHT
Created by admin on Sat Dec 16 10:57:41 GMT 2023 , Edited by admin on Sat Dec 16 10:57:41 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY