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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-BUTYLPHENYL)-5-PHENYL-S-TRIAZOLE

SMILES

CCCCC1=CC=CC=C1C2=NN=C(N2)C3=CC=CC=C3

InChI

InChIKey=NEEHHGCSOUSERQ-UHFFFAOYSA-N
InChI=1S/C18H19N3/c1-2-3-9-14-10-7-8-13-16(14)18-19-17(20-21-18)15-11-5-4-6-12-15/h4-8,10-13H,2-3,9H2,1H3,(H,19,20,21)

HIDE SMILES / InChI

Approval Year

Name Type Language
3-(O-BUTYLPHENYL)-5-PHENYL-S-TRIAZOLE
Common Name English
S-TRIAZOLE, 3-(O-BUTYLPHENYL)-5-PHENYL-
Preferred Name English
5-(2-BUTYLPHENYL)-3-PHENYL-1H-1,2,4-TRIAZOLE
Systematic Name English
1H-1,2,4-TRIAZOLE, 3-(2-BUTYLPHENYL)-5-PHENYL-
Systematic Name English
1H-1,2,4-TRIAZOLE, 5-(2-BUTYLPHENYL)-3-PHENYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
135355
Created by admin on Mon Mar 31 22:00:04 GMT 2025 , Edited by admin on Mon Mar 31 22:00:04 GMT 2025
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CAS
85303-88-4
Created by admin on Mon Mar 31 22:00:04 GMT 2025 , Edited by admin on Mon Mar 31 22:00:04 GMT 2025
PRIMARY
FDA UNII
969DL42Q8Q
Created by admin on Mon Mar 31 22:00:04 GMT 2025 , Edited by admin on Mon Mar 31 22:00:04 GMT 2025
PRIMARY
EPA CompTox
DTXSID401005792
Created by admin on Mon Mar 31 22:00:04 GMT 2025 , Edited by admin on Mon Mar 31 22:00:04 GMT 2025
PRIMARY