N-(5-chloranyl-2-piperidin-1-yl-phenyl)-1,3,6-trimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-piperidin-1-yl-phenyl)-1,3,6-trimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-[5-chloro-2-(1-piperidyl)phenyl]-1,3,6-trimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[5-chloro-2-(1-piperidinyl)phenyl]-1,3,6-trimethyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(5-chloro-2-piperidin-1-ylphenyl)-1,3,6-trimethylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(5-chloro-2-piperidino-phenyl)-1,3,6-trimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C21H24ClN5O MolecularWeight: 397.90116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C)C)C(=C1)C(=O)NC3=C(C=CC(=C3)Cl)N4CCCCC4

Isomeric SMILES

CC1=NC2=C(C(=NN2C)C)C(=C1)C(=O)NC3=C(C=CC(=C3)Cl)N4CCCCC4

InChI

InChI=1S/C21H24ClN5O/c1-13-11-16(19-14(2)25-26(3)20(19)23-13)21(28)24-17-12-15(22)7-8-18(17)27-9-5-4-6-10-27/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,24,28)