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CHEBI:121689 - 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N-(3-phenylpropylideneamino)-4-triazolecarboxamide

Default Structure
ChEBI IDCHEBI:121689
ChEBI Name1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N-(3-phenylpropylideneamino)-4-triazolecarboxamide
Stars
DownloadsMolfile
FormulaC17H21N9O2
Net Charge0
Average Mass383.416
Monoisotopic Mass383.18182
SMILESCN(C)Cc1c(C(=O)NN=CCCc2ccccc2)nnn1-c1nonc1N
InChIInChI=1S/C17H21N9O2/c1-25(2)11-13-14(20-24-26(13)16-15(18)22-28-23-16)17(27)21-19-10-6-9-12-7-4-3-5-8-12/h3-5,7-8,10H,6,9,11H2,1-2H3,(H2,18,22)(H,21,27)
InChIKeyIARUDCZFHJJBRS-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N-(3-phenylpropylideneamino)-4-triazolecarboxamide (CHEBI:121689) is a aralkylamine (CHEBI:18000)
Manual XrefsDatabases
LSM-33132LINCS