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

Systemtic Name: N-(2-acetamidoethyl)-1-(furan-2-ylmethyl)-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-(2-acetamidoethyl)-1-(2-furylmethyl)-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-(2-acetamidoethyl)-1-(2-furanylmethyl)-6-phenyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(2-acetamidoethyl)-1-(furan-2-ylmethyl)-6-phenylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(2-acetamidoethyl)-1-(2-furfuryl)-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1=CC(=NC2=C1C=NN2CC3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCNC(=O)C1=CC(=NC2=C1C=NN2CC3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N5O3/c1-15(28)23-9-10-24-22(29)18-12-20(16-6-3-2-4-7-16)26-21-19(18)13-25-27(21)14-17-8-5-11-30-17/h2-8,11-13H,9-10,14H2,1H3,(H,23,28)(H,24,29)