3-(4-chlorophenyl)-4-[(3-methoxyphenyl)amino]-1-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 3-(4-chlorophenyl)-4-[(3-methoxyphenyl)amino]-1-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 3-(4-chlorophenyl)-4-(3-methoxyanilino)-1-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 3-(4-chlorophenyl)-4-(3-methoxyanilino)-1-methyl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 3-(4-chlorophenyl)-4-(3-methoxyanilino)-1-methylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 3-(4-chlorophenyl)-4-(m-anisidino)-1-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C21H18ClN5O2 MolecularWeight: 407.85292

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC=C(C(=C2C(=N1)C3=CC=C(C=C3)Cl)NC4=CC(=CC=C4)OC)C(=O)N

Isomeric SMILES

CN1C2=NC=C(C(=C2C(=N1)C3=CC=C(C=C3)Cl)NC4=CC(=CC=C4)OC)C(=O)N

InChI

InChI=1S/C21H18ClN5O2/c1-27-21-17(18(26-27)12-6-8-13(22)9-7-12)19(16(11-24-21)20(23)28)25-14-4-3-5-15(10-14)29-2/h3-11H,1-2H3,(H2,23,28)(H,24,25)