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Details

Stereochemistry ACHIRAL
Molecular Formula C18H19N3
Molecular Weight 277.3636
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(O-ETHYLPHENYL)-5-(2,3-XYLYL)-S-TRIAZOLE

SMILES

CCC1=CC=CC=C1C2=NN=C(N2)C3=C(C)C(C)=CC=C3

InChI

InChIKey=UZUVFACVCVJXBX-UHFFFAOYSA-N
InChI=1S/C18H19N3/c1-4-14-9-5-6-10-16(14)18-19-17(20-21-18)15-11-7-8-12(2)13(15)3/h5-11H,4H2,1-3H3,(H,19,20,21)

HIDE SMILES / InChI

Molecular Formula C18H19N3
Molecular Weight 277.3636
Charge 0
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 08:19:05 GMT 2023
Edited
by admin
on Sat Dec 16 08:19:05 GMT 2023
Record UNII
1MGL65F90N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(O-ETHYLPHENYL)-5-(2,3-XYLYL)-S-TRIAZOLE
Common Name English
S-TRIAZOLE, 3-(O-ETHYLPHENYL)-5-(2,3-XYLYL)-
Common Name English
1H-1,2,4-TRIAZOLE, 3-(2,3-DIMETHYLPHENYL)-5-(2-ETHYLPHENYL)-
Systematic Name English
5-(2,3-DIMETHYLPHENYL)-3-(2-ETHYLPHENYL)-1H-1,2,4-TRIAZOLE
Systematic Name English
Code System Code Type Description
PUBCHEM
174439
Created by admin on Sat Dec 16 08:19:05 GMT 2023 , Edited by admin on Sat Dec 16 08:19:05 GMT 2023
PRIMARY
FDA UNII
1MGL65F90N
Created by admin on Sat Dec 16 08:19:05 GMT 2023 , Edited by admin on Sat Dec 16 08:19:05 GMT 2023
PRIMARY
EPA CompTox
DTXSID50234510
Created by admin on Sat Dec 16 08:19:05 GMT 2023 , Edited by admin on Sat Dec 16 08:19:05 GMT 2023
PRIMARY
CAS
85303-84-0
Created by admin on Sat Dec 16 08:19:05 GMT 2023 , Edited by admin on Sat Dec 16 08:19:05 GMT 2023
PRIMARY