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

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-6-methyl-1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=NN(C2=N1)C(C)C)C(=O)NCCSCC3=CC=CO3

Isomeric SMILES

CC1=C(C=C2C=NN(C2=N1)C(C)C)C(=O)NCCSCC3=CC=CO3

InChI

InChI=1S/C18H22N4O2S/c1-12(2)22-17-14(10-20-22)9-16(13(3)21-17)18(23)19-6-8-25-11-15-5-4-7-24-15/h4-5,7,9-10,12H,6,8,11H2,1-3H3,(H,19,23)