(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 1,3-dimethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 1,3-dimethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 1,3-dimethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1,3-dimethyl-6-phenyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 1,3-dimethyl-6-phenylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1,3-dimethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C25H22N8O2 MolecularWeight: 466.49458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)OCC4=NC(=NC(=N4)NC5=CC=CC=C5)N)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)OCC4=NC(=NC(=N4)NC5=CC=CC=C5)N)C

InChI

InChI=1S/C25H22N8O2/c1-15-21-18(13-19(16-9-5-3-6-10-16)28-22(21)33(2)32-15)23(34)35-14-20-29-24(26)31-25(30-20)27-17-11-7-4-8-12-17/h3-13H,14H2,1-2H3,(H3,26,27,29,30,31)