N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1-benzyl-N-[2-(2-furylmethylamino)-2-oxo-ethyl]pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[2-(2-furanylmethylamino)-2-oxoethyl]-1-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1-benzyl-N-[2-(2-furfurylamino)-2-keto-ethyl]pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C21H19N5O3 MolecularWeight: 389.40726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=NC=C(C=C3C=N2)C(=O)NCC(=O)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=NC=C(C=C3C=N2)C(=O)NCC(=O)NCC4=CC=CO4

InChI

InChI=1S/C21H19N5O3/c27-19(22-12-18-7-4-8-29-18)13-24-21(28)17-9-16-11-25-26(20(16)23-10-17)14-15-5-2-1-3-6-15/h1-11H,12-14H2,(H,22,27)(H,24,28)