4-(tert-butylamino)-1-ethyl-N-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 4-(tert-butylamino)-1-ethyl-N-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-benzyl-4-(tert-butylamino)-1-ethyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 4-(tert-butylamino)-1-ethyl-N-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-benzyl-4-(tert-butylamino)-1-ethylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-benzyl-4-(tert-butylamino)-1-ethyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C20H25N5O MolecularWeight: 351.4454

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC=C(C(=C2C=N1)NC(C)(C)C)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCN1C2=NC=C(C(=C2C=N1)NC(C)(C)C)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H25N5O/c1-5-25-18-15(13-23-25)17(24-20(2,3)4)16(12-21-18)19(26)22-11-14-9-7-6-8-10-14/h6-10,12-13H,5,11H2,1-4H3,(H,21,24)(H,22,26)