4-(2-bromanyl-3-cyano-phenyl)-6-cycloheptyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile

Systemtic Name: 4-(2-bromanyl-3-cyano-phenyl)-6-cycloheptyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile Openeye Name: 4-(2-bromo-3-cyano-phenyl)-6-cycloheptyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile CAS Name: 4-(2-bromo-3-cyanophenyl)-6-cycloheptyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile IUPAC Name: 4-(2-bromo-3-cyanophenyl)-6-cycloheptyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile Traditional Name: 4-(2-bromo-3-cyano-phenyl)-6-cycloheptyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile Formula: C21H20BrN5 MolecularWeight: 422.321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C2=C(C(C3=CNNC3=N2)C4=CC=CC(=C4Br)C#N)C#N

Isomeric SMILES

C1CCCC(CC1)C2=C(C(C3=CNNC3=N2)C4=CC=CC(=C4Br)C#N)C#N

InChI

InChI=1S/C21H20BrN5/c22-19-14(10-23)8-5-9-15(19)18-16(11-24)20(13-6-3-1-2-4-7-13)26-21-17(18)12-25-27-21/h5,8-9,12-13,18H,1-4,6-7H2,(H2,25,26,27)