N-[1-(4-fluorophenyl)-2-methyl-propan-2-yl]-1,3-dimethyl-4-propan-2-ylsulfanyl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-[1-(4-fluorophenyl)-2-methyl-propan-2-yl]-1,3-dimethyl-4-propan-2-ylsulfanyl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-[2-(4-fluorophenyl)-1,1-dimethyl-ethyl]-4-isopropylsulfanyl-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-1,3-dimethyl-4-(propan-2-ylthio)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-1,3-dimethyl-4-propan-2-ylsulfanylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-[2-(4-fluorophenyl)-1,1-dimethyl-ethyl]-4-(isopropylthio)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C22H27FN4OS MolecularWeight: 414.539383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C(=C12)SC(C)C)C(=O)NC(C)(C)CC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=NN(C2=NC=C(C(=C12)SC(C)C)C(=O)NC(C)(C)CC3=CC=C(C=C3)F)C

InChI

InChI=1S/C22H27FN4OS/c1-13(2)29-19-17(12-24-20-18(19)14(3)26-27(20)6)21(28)25-22(4,5)11-15-7-9-16(23)10-8-15/h7-10,12-13H,11H2,1-6H3,(H,25,28)