N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-1,6-dimethyl-3-oxidanylidene-2H-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-1,6-dimethyl-3-oxidanylidene-2H-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-[4-(2-furylmethylcarbamoylamino)phenyl]-1,6-dimethyl-3-oxo-2H-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[4-[[(2-furanylmethylamino)-oxomethyl]amino]phenyl]-1,6-dimethyl-3-oxo-2H-pyrazolo[3,4-b]pyridine-4-carboxamide IUPAC Name: N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-1,6-dimethyl-3-oxo-2H-pyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-[4-(2-furfurylcarbamoylamino)phenyl]-3-keto-1,6-dimethyl-2H-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C21H20N6O4 MolecularWeight: 420.4213

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C1)C(=O)NC3=CC=C(C=C3)NC(=O)NCC4=CC=CO4)C(=O)NN2C

Isomeric SMILES

CC1=NC2=C(C(=C1)C(=O)NC3=CC=C(C=C3)NC(=O)NCC4=CC=CO4)C(=O)NN2C

InChI

InChI=1S/C21H20N6O4/c1-12-10-16(17-18(23-12)27(2)26-20(17)29)19(28)24-13-5-7-14(8-6-13)25-21(30)22-11-15-4-3-9-31-15/h3-10H,11H2,1-2H3,(H,24,28)(H,26,29)(H2,22,25,30)