1-[(2S)-butan-2-yl]-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: 1-[(2S)-butan-2-yl]-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: 1-[(1S)-1-methylpropyl]-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-[(2S)-butan-2-yl]-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylate IUPAC Name: 1-[(2S)-butan-2-yl]-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-[(1S)-1-methylpropyl]-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxylate Formula: C15H14N3O2S- MolecularWeight: 300.35556

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)[O-]

Isomeric SMILES

CC[C@H](C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)[O-]

InChI

InChI=1S/C15H15N3O2S/c1-3-9(2)18-14-11(8-16-18)10(15(19)20)7-12(17-14)13-5-4-6-21-13/h4-9H,3H2,1-2H3,(H,19,20)/p-1/t9-/m0/s1