1-(3-chloranyl-2-methyl-phenyl)-3,6-dimethyl-N-(3-propylsulfanylpropyl)pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3,6-dimethyl-N-(3-propylsulfanylpropyl)pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3,6-dimethyl-N-(3-propylsulfanylpropyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: 1-(3-chloro-2-methylphenyl)-3,6-dimethyl-N-[3-(propylthio)propyl]-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-(3-chloro-2-methylphenyl)-3,6-dimethyl-N-(3-propylsulfanylpropyl)pyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3,6-dimethyl-N-[3-(propylthio)propyl]pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C22H27ClN4OS MolecularWeight: 430.99398

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCCCNC(=O)C1=CC(=NC2=C1C(=NN2C3=C(C(=CC=C3)Cl)C)C)C

Isomeric SMILES

CCCSCCCNC(=O)C1=CC(=NC2=C1C(=NN2C3=C(C(=CC=C3)Cl)C)C)C

InChI

InChI=1S/C22H27ClN4OS/c1-5-11-29-12-7-10-24-22(28)17-13-14(2)25-21-20(17)16(4)26-27(21)19-9-6-8-18(23)15(19)3/h6,8-9,13H,5,7,10-12H2,1-4H3,(H,24,28)