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Details

Stereochemistry ACHIRAL
Molecular Formula C19H20N8
Molecular Weight 360.4157
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(BIS(1H-1,2,4-TRIAZOL-1-YL)METHYL)-.ALPHA.1,.ALPHA.1,.ALPHA.3,.ALPHA.3-TETRAMETHYL-1,3-BENZENEDIACETONITRILE

SMILES

CC(C)(C#N)C1=CC(=CC(=C1)C(N2C=NC=N2)N3C=NC=N3)C(C)(C)C#N

InChI

InChIKey=WUHGDOYIJRDZCN-UHFFFAOYSA-N
InChI=1S/C19H20N8/c1-18(2,8-20)15-5-14(6-16(7-15)19(3,4)9-21)17(26-12-22-10-24-26)27-13-23-11-25-27/h5-7,10-13,17H,1-4H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
1,3-BENZENEDIACETONITRILE, 5-(BIS(1H-1,2,4-TRIAZOL-1-YL)METHYL)-.ALPHA.1,.ALPHA.1,.ALPHA.3,.ALPHA.3-TETRAMETHYL-
Preferred Name English
5-(BIS(1H-1,2,4-TRIAZOL-1-YL)METHYL)-.ALPHA.1,.ALPHA.1,.ALPHA.3,.ALPHA.3-TETRAMETHYL-1,3-BENZENEDIACETONITRILE
Systematic Name English
Code System Code Type Description
CAS
1186102-55-5
Created by admin on Mon Mar 31 23:39:59 GMT 2025 , Edited by admin on Mon Mar 31 23:39:59 GMT 2025
PRIMARY
PUBCHEM
69443440
Created by admin on Mon Mar 31 23:39:59 GMT 2025 , Edited by admin on Mon Mar 31 23:39:59 GMT 2025
PRIMARY
FDA UNII
RBW4B7AR7S
Created by admin on Mon Mar 31 23:39:59 GMT 2025 , Edited by admin on Mon Mar 31 23:39:59 GMT 2025
PRIMARY
NIH
NCATS
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