N-(2-chloranylpyridin-3-yl)-3,6-dimethyl-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-(2-chloranylpyridin-3-yl)-3,6-dimethyl-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: 1-benzyl-N-(2-chloro-3-pyridyl)-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-(2-chloro-3-pyridinyl)-3,6-dimethyl-1-(phenylmethyl)-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N-(2-chloropyridin-3-yl)-3,6-dimethylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: 1-benzyl-N-(2-chloro-3-pyridyl)-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C21H18ClN5O MolecularWeight: 391.85352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2CC3=CC=CC=C3)C)C(=C1)C(=O)NC4=C(N=CC=C4)Cl

Isomeric SMILES

CC1=NC2=C(C(=NN2CC3=CC=CC=C3)C)C(=C1)C(=O)NC4=C(N=CC=C4)Cl

InChI

InChI=1S/C21H18ClN5O/c1-13-11-16(21(28)25-17-9-6-10-23-19(17)22)18-14(2)26-27(20(18)24-13)12-15-7-4-3-5-8-15/h3-11H,12H2,1-2H3,(H,25,28)