methyl 3-[(3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]benzoate

Systemtic Name: methyl 3-[(3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]benzoate Openeye Name: methyl 3-[(3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]benzoate CAS Name: 3-[[(3-methyl-1,6-diphenyl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(3-methyl-1,6-diphenylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]benzoate Traditional Name: 3-[(3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]benzoic acid methyl ester Formula: C28H22N4O3 MolecularWeight: 462.49928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C(=O)OC)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C(=O)OC)C5=CC=CC=C5

InChI

InChI=1S/C28H22N4O3/c1-18-25-23(27(33)29-21-13-9-12-20(16-21)28(34)35-2)17-24(19-10-5-3-6-11-19)30-26(25)32(31-18)22-14-7-4-8-15-22/h3-17H,1-2H3,(H,29,33)