3-tert-butyl-5-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one

Systemtic Name: 3-tert-butyl-5-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 3-tert-butyl-5-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 3-tert-butyl-5-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 3-tert-butyl-5-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 3-tert-butyl-5-[(homoveratrylamino)methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C27H32N4O3 MolecularWeight: 460.56798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C=C(C(=O)N=C2N(N1)C3=CC=CC=C3)CNCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(C)(C)C1=C2C=C(C(=O)N=C2N(N1)C3=CC=CC=C3)CNCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H32N4O3/c1-27(2,3)24-21-16-19(17-28-14-13-18-11-12-22(33-4)23(15-18)34-5)26(32)29-25(21)31(30-24)20-9-7-6-8-10-20/h6-12,15-16,28,30H,13-14,17H2,1-5H3