CHEBI:109606 - N2-[(4-methoxy-3-nitrophenyl)methylideneamino]-N4-phenyl-6-(1-pyrrolidinyl)-1,3,5-triazine-2,4-diamine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N2-[(4-methoxy-3-nitrophenyl)methylideneamino]-N4-phenyl-6-(1-pyrrolidinyl)-1,3,5-triazine-2,4-diamine
ChEBI ID CHEBI:109606
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C21H22N8O3
Net Charge 0
Average Mass 434.452
Monoisotopic Mass 434.18149
InChI InChI=1S/C21H22N8O3/c1-32-18-10-9-15(13-17(18)29(30)31)14-22-27-20-24-19(23-16-7-3-2-4-8-16)25-21(26-20)28-11-5-6-12-28/h2-4,7-10,13-14H,5-6,11-12H2,1H3,(H2,23,24,25,26,27)
InChIKey LHZYCIWASXAPRQ-UHFFFAOYSA-N
SMILES COC1=C(C=C(C=C1)C=NNC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCCC4)[N+](=O)[O-]
ChEBI Ontology
Outgoing N2-[(4-methoxy-3-nitrophenyl)methylideneamino]-N4-phenyl-6-(1-pyrrolidinyl)-1,3,5-triazine-2,4-diamine (CHEBI:109606) is a C-nitro compound (CHEBI:35716)
N2-[(4-methoxy-3-nitrophenyl)methylideneamino]-N4-phenyl-6-(1-pyrrolidinyl)-1,3,5-triazine-2,4-diamine (CHEBI:109606) is a aromatic ether (CHEBI:35618)
Manual Xref Database
LSM-21034 LINCS
View more database links