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1-(1-tert-butyl-5-tetrazolyl)-N-(2-furanylmethyl)-N-(phenylmethyl)-1-[4-(trifluoromethyl)phenyl]methanamine

PropertiesImage
MNX_IDMNXM179547 Image of MNXM179547
referencechebi:112316
formulaC25H26F3N5O
global charge0
mol weight469.511
InChIKeyGJCKFQOJOGUGHY-UHFFFAOYSA-N
InChIInChI=1S/C25H26F3N5O/c1-24(2,3)33-23(29-30-31-33)22(19-11-13-20(14-12-19)25(26,27)28)32(17-21-10-7-15-34-21)16-18-8-5-4-6-9-18/h4-15,22H,16-17H2,1-3H3
SMILESCC(C)(C)N1N=NN=C1C(C1=CC=C(C(F)(F)F)C=C1)N(CC1=CC=CC=C1)CC1=CC=CO1
MNX internals
InChI (mnx)InChI=1/C25H26F3N5O/c1-24(2,3)33-23(29-30-31-33)22(19-11-13-20(14-12-19)25(26,27)28)32(17-21-10-7-15-34-21)16-18-8-5-4-6-9-18/h4-15,22H,16-17H2,1-3H3/t22? Image of MNXM179547
SMILES (mnx)[CH3:1][C:24]([CH3:2])([CH3:3])[N:33]1[C:23]([CH:22]([C:19]2=[CH:12][CH:14]=[C:20]([C:25]([F:26])([F:27])[F:28])[CH:13]=[CH:11]2)[N:32]([CH2:16][C:18]2=[CH:8][CH:5]=[CH:4][CH:6]=[CH:9]2)[CH2:17][C:21]2=[CH:10][CH:7]=[CH:15][O:34]2)=[N:29][N:30]=[N:31]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:112316
chebi:112316
GJCKFQOJOGUGHY-UHFFFAOYSA-N
1-(1-tert-butyl-5-tetrazolyl)-N-(2-furanylmethyl)-N-(phenylmethyl)-1-[4-(trifluoromethyl)phenyl]methanamine