N-[(2S)-butan-2-yl]-1-(furan-2-ylmethyl)-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-1-(furan-2-ylmethyl)-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: 1-(2-furylmethyl)-N-[(1S)-1-methylpropyl]-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[(2S)-butan-2-yl]-1-(2-furanylmethyl)-6-phenyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-1-(furan-2-ylmethyl)-6-phenylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: 1-(2-furfuryl)-N-[(1S)-1-methylpropyl]-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=NC2=C1C=NN2CC3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC(=NC2=C1C=NN2CC3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4O2/c1-3-15(2)24-22(27)18-12-20(16-8-5-4-6-9-16)25-21-19(18)13-23-26(21)14-17-10-7-11-28-17/h4-13,15H,3,14H2,1-2H3,(H,24,27)/t15-/m0/s1