N-(1-adamantyl)-3-methyl-1-(4-methylphenyl)-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-(1-adamantyl)-3-methyl-1-(4-methylphenyl)-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-(1-adamantyl)-3-methyl-6-phenyl-1-(p-tolyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-(1-adamantyl)-3-methyl-1-(4-methylphenyl)-6-phenyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(1-adamantyl)-3-methyl-1-(4-methylphenyl)-6-phenylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(1-adamantyl)-3-methyl-6-phenyl-1-(p-tolyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C31H32N4O MolecularWeight: 476.61198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C(=N2)C)C(=CC(=N3)C4=CC=CC=C4)C(=O)NC56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C(=N2)C)C(=CC(=N3)C4=CC=CC=C4)C(=O)NC56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C31H32N4O/c1-19-8-10-25(11-9-19)35-29-28(20(2)34-35)26(15-27(32-29)24-6-4-3-5-7-24)30(36)33-31-16-21-12-22(17-31)14-23(13-21)18-31/h3-11,15,21-23H,12-14,16-18H2,1-2H3,(H,33,36)