1,3,6-trimethyl-N-[4-(prop-2-enylcarbamoylamino)phenyl]pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: 1,3,6-trimethyl-N-[4-(prop-2-enylcarbamoylamino)phenyl]pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-[4-(allylcarbamoylamino)phenyl]-1,3,6-trimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: 1,3,6-trimethyl-N-[4-[[oxo-(prop-2-enylamino)methyl]amino]phenyl]-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1,3,6-trimethyl-N-[4-(prop-2-enylcarbamoylamino)phenyl]pyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-[4-(allylcarbamoylamino)phenyl]-1,3,6-trimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C20H22N6O2 MolecularWeight: 378.42768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N6O2/c1-5-10-21-20(28)24-15-8-6-14(7-9-15)23-19(27)16-11-12(2)22-18-17(16)13(3)25-26(18)4/h5-9,11H,1,10H2,2-4H3,(H,23,27)(H2,21,24,28)