N-(3-methylsulfanylphenyl)-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-(3-methylsulfanylphenyl)-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1-benzyl-N-(3-methylsulfanylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[3-(methylthio)phenyl]-1-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N-(3-methylsulfanylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1-benzyl-N-[3-(methylthio)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C21H18N4OS MolecularWeight: 374.45882

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2=CN=C3C(=C2)C=NN3CC4=CC=CC=C4

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C2=CN=C3C(=C2)C=NN3CC4=CC=CC=C4

InChI

InChI=1S/C21H18N4OS/c1-27-19-9-5-8-18(11-19)24-21(26)17-10-16-13-23-25(20(16)22-12-17)14-15-6-3-2-4-7-15/h2-13H,14H2,1H3,(H,24,26)