butyl 4-[(1,3,6-trimethylpyrazolo[3,4-b]pyridin-4-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(1,3,6-trimethylpyrazolo[3,4-b]pyridin-4-yl)carbonylamino]benzoate Openeye Name: butyl 4-[(1,3,6-trimethylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]benzoate CAS Name: 4-[[oxo-(1,3,6-trimethyl-4-pyrazolo[3,4-b]pyridinyl)methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(1,3,6-trimethylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]benzoate Traditional Name: 4-[(1,3,6-trimethylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]benzoic acid butyl ester Formula: C21H24N4O3 MolecularWeight: 380.44026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=C2C(=NN3C)C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=C2C(=NN3C)C)C

InChI

InChI=1S/C21H24N4O3/c1-5-6-11-28-21(27)15-7-9-16(10-8-15)23-20(26)17-12-13(2)22-19-18(17)14(3)24-25(19)4/h7-10,12H,5-6,11H2,1-4H3,(H,23,26)