CHEBI:107929 - N-methyl-2-[[4-methyl-5-[(4-nitrophenoxy)methyl]-1,2,4-triazol-3-yl]thio]acetamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-methyl-2-[[4-methyl-5-[(4-nitrophenoxy)methyl]-1,2,4-triazol-3-yl]thio]acetamide
ChEBI ID CHEBI:107929
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C13H15N5O4S
Net Charge 0
Average Mass 337.356
Monoisotopic Mass 337.08448
InChI InChI=1S/C13H15N5O4S/c1-14-12(19)8-23-13-16-15-11(17(13)2)7-22-10-5-3-9(4-6-10)18(20)21/h3-6H,7-8H2,1-2H3,(H,14,19)
InChIKey FIHFVZJDXRIOLX-UHFFFAOYSA-N
SMILES CNC(=O)CSC1=NN=C(N1C)COC2=CC=C(C=C2)[N+](=O)[O-]
ChEBI Ontology
Outgoing N-methyl-2-[[4-methyl-5-[(4-nitrophenoxy)methyl]-1,2,4-triazol-3-yl]thio]acetamide (CHEBI:107929) is a C-nitro compound (CHEBI:35716)
N-methyl-2-[[4-methyl-5-[(4-nitrophenoxy)methyl]-1,2,4-triazol-3-yl]thio]acetamide (CHEBI:107929) is a aromatic ether (CHEBI:35618)
Manual Xref Database
LSM-19306 LINCS
View more database links