N-[(3S)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-6-phenyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-[(3S)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-6-phenyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: 1-isopropyl-N-[(3S)-3-methyl-1,1-dioxo-thiolan-3-yl]-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[(3S)-3-methyl-1,1-dioxo-3-thiolanyl]-6-phenyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[(3S)-3-methyl-1,1-dioxothiolan-3-yl]-6-phenyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-[(3S)-1,1-diketo-3-methyl-thiolan-3-yl]-1-isopropyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4(CCS(=O)(=O)C4)C

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)N[C@]4(CCS(=O)(=O)C4)C

InChI

InChI=1S/C21H24N4O3S/c1-14(2)25-19-17(12-22-25)16(11-18(23-19)15-7-5-4-6-8-15)20(26)24-21(3)9-10-29(27,28)13-21/h4-8,11-12,14H,9-10,13H2,1-3H3,(H,24,26)/t21-/m0/s1