N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-6-methyl-1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=NN(C2=N1)C(C)C)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

CC1=C(C=C2C=NN(C2=N1)C(C)C)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C21H23N5OS/c1-14(2)26-20-18(12-24-26)10-19(15(3)25-20)21(27)23-8-9-28-13-17-7-5-4-6-16(17)11-22/h4-7,10,12,14H,8-9,13H2,1-3H3,(H,23,27)