6-(4-bromophenyl)-1-butyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine

Systemtic Name: 6-(4-bromophenyl)-1-butyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine Openeye Name: 6-(4-bromophenyl)-1-butyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine CAS Name: 6-(4-bromophenyl)-1-butyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine IUPAC Name: 6-(4-bromophenyl)-1-butyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine Traditional Name: 6-(4-bromophenyl)-1-butyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine Formula: C18H17BrF3N3 MolecularWeight: 412.24689

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=N1)C)C(=CC(=N2)C3=CC=C(C=C3)Br)C(F)(F)F

Isomeric SMILES

CCCCN1C2=C(C(=N1)C)C(=CC(=N2)C3=CC=C(C=C3)Br)C(F)(F)F

InChI

InChI=1S/C18H17BrF3N3/c1-3-4-9-25-17-16(11(2)24-25)14(18(20,21)22)10-15(23-17)12-5-7-13(19)8-6-12/h5-8,10H,3-4,9H2,1-2H3