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CHEBI:39625 - N-{2-[(N,N-DIETHYLGLYCYL)AMINO]-5-(TRIFLUOROMETHYL)PHENYL}-4-METHYL-3-[2-(METHYLAMINO)QUINAZOLIN-6-YL]BENZAMIDE

Default Structure
ChEBI IDCHEBI:39625
ChEBI NameN-{2-[(N,N-DIETHYLGLYCYL)AMINO]-5-(TRIFLUOROMETHYL)PHENYL}-4-METHYL-3-[2-(METHYLAMINO)QUINAZOLIN-6-YL]BENZAMIDE
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC30H31F3N6O2
Net Charge0
Average Mass564.612
Monoisotopic Mass564.24606
SMILES[H]c1c([H])c(C([H])([H])[H])c(-c2c([H])c([H])c3nc(N([H])C([H])([H])[H])nc([H])c3c2[H])c([H])c1C(=O)N([H])c1c([H])c(C(F)(F)F)c([H])c([H])c1N([H])C(=O)C([H])([H])N(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H]
InChIInChI=1S/C30H31F3N6O2/c1-5-39(6-2)17-27(40)36-25-12-10-22(30(31,32)33)15-26(25)37-28(41)20-8-7-18(3)23(14-20)19-9-11-24-21(13-19)16-35-29(34-4)38-24/h7-16H,5-6,17H2,1-4H3,(H,36,40)(H,37,41)(H,34,35,38)
InChIKeyYGLITMMDQOZAHY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-{2-[(N,N-DIETHYLGLYCYL)AMINO]-5-(TRIFLUOROMETHYL)PHENYL}-4-METHYL-3-[2-(METHYLAMINO)QUINAZOLIN-6-YL]BENZAMIDE (CHEBI:39625) is a unclassifieds (CHEBI:27189)
Synonyms  Source
N-{2-[(N,N-diethylglycyl)amino]-5-(trifluoromethyl)phenyl}-4-methyl-3-[2-(methylamino)quinazolin-6-yl]benzamidePDBeChem
N-{2-[(N,N-DIETHYLGLYCYL)AMINO]-5-(TRIFLUOROMETHYL)PHENYL}-4-METHYL-3-[2-(METHYLAMINO)QUINAZOLIN-6-YL]BENZAMIDEPDBeChem
Manual XrefsDatabases
1N8PDBeChem