N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N-methyl-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N-methyl-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1-benzyl-N-[2-(tert-butylamino)-2-oxo-ethyl]-N-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-1-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N-[2-(tert-butylamino)-2-oxoethyl]-N-methylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1-benzyl-N-[2-(tert-butylamino)-2-keto-ethyl]-N-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)C(=O)C1=CN=C2C(=C1)C=NN2CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)C(=O)C1=CN=C2C(=C1)C=NN2CC3=CC=CC=C3

InChI

InChI=1S/C21H25N5O2/c1-21(2,3)24-18(27)14-25(4)20(28)17-10-16-12-23-26(19(16)22-11-17)13-15-8-6-5-7-9-15/h5-12H,13-14H2,1-4H3,(H,24,27)