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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C(=C12)NC3=CC(=CC=C3)OC)C(=O)N)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NN(C2=NC=C(C(=C12)NC3=CC(=CC=C3)OC)C(=O)N)C4=CC=C(C=C4)Cl

InChI

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