5-[[(4-cyclohexylphenyl)amino]methyl]-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one

Systemtic Name: 5-[[(4-cyclohexylphenyl)amino]methyl]-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 5-[(4-cyclohexylanilino)methyl]-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 5-[(4-cyclohexylanilino)methyl]-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 5-[(4-cyclohexylanilino)methyl]-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 5-[(4-cyclohexylanilino)methyl]-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C26H28N4O MolecularWeight: 412.52672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)N=C2N(N1)C3=CC=CC=C3)CNC4=CC=C(C=C4)C5CCCCC5

Isomeric SMILES

CC1=C2C=C(C(=O)N=C2N(N1)C3=CC=CC=C3)CNC4=CC=C(C=C4)C5CCCCC5

InChI

InChI=1S/C26H28N4O/c1-18-24-16-21(26(31)28-25(24)30(29-18)23-10-6-3-7-11-23)17-27-22-14-12-20(13-15-22)19-8-4-2-5-9-19/h3,6-7,10-16,19,27,29H,2,4-5,8-9,17H2,1H3