1,3-dimethyl-4-[(4-methylphenyl)amino]-N-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 1,3-dimethyl-4-[(4-methylphenyl)amino]-N-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1,3-dimethyl-4-(4-methylanilino)-N-(3-pyridylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 1,3-dimethyl-4-(4-methylanilino)-N-(3-pyridinylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1,3-dimethyl-4-(4-methylanilino)-N-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1,3-dimethyl-4-(p-toluidino)-N-(3-pyridylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C22H22N6O MolecularWeight: 386.44968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C3C(=NN(C3=NC=C2C(=O)NCC4=CN=CC=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C3C(=NN(C3=NC=C2C(=O)NCC4=CN=CC=C4)C)C

InChI

InChI=1S/C22H22N6O/c1-14-6-8-17(9-7-14)26-20-18(13-24-21-19(20)15(2)27-28(21)3)22(29)25-12-16-5-4-10-23-11-16/h4-11,13H,12H2,1-3H3,(H,24,26)(H,25,29)