3-(4,6-dimethyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-5-yl)-N-(2-phenylsulfanylethyl)propanamide

Systemtic Name: 3-(4,6-dimethyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-5-yl)-N-(2-phenylsulfanylethyl)propanamide Openeye Name: 3-(1-isopropyl-4,6-dimethyl-pyrazolo[3,4-b]pyridin-5-yl)-N-(2-phenylsulfanylethyl)propanamide CAS Name: 3-(4,6-dimethyl-1-propan-2-yl-5-pyrazolo[3,4-b]pyridinyl)-N-[2-(phenylthio)ethyl]propanamide IUPAC Name: 3-(4,6-dimethyl-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)-N-(2-phenylsulfanylethyl)propanamide Traditional Name: 3-(1-isopropyl-4,6-dimethyl-pyrazolo[3,4-b]pyridin-5-yl)-N-[2-(phenylthio)ethyl]propionamide Formula: C22H28N4OS MolecularWeight: 396.54892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=NN(C2=NC(=C1CCC(=O)NCCSC3=CC=CC=C3)C)C(C)C

Isomeric SMILES

CC1=C2C=NN(C2=NC(=C1CCC(=O)NCCSC3=CC=CC=C3)C)C(C)C

InChI

InChI=1S/C22H28N4OS/c1-15(2)26-22-20(14-24-26)16(3)19(17(4)25-22)10-11-21(27)23-12-13-28-18-8-6-5-7-9-18/h5-9,14-15H,10-13H2,1-4H3,(H,23,27)