N-butyl-N-methyl-1-pyridin-2-yl-4-thiophen-2-yl-pyrazolo[3,4-b]pyridine-3-carboxamide

Systemtic Name: N-butyl-N-methyl-1-pyridin-2-yl-4-thiophen-2-yl-pyrazolo[3,4-b]pyridine-3-carboxamide Openeye Name: N-butyl-N-methyl-1-(2-pyridyl)-4-(2-thienyl)pyrazolo[3,4-b]pyridine-3-carboxamide CAS Name: N-butyl-N-methyl-1-(2-pyridinyl)-4-thiophen-2-yl-3-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-butyl-N-methyl-1-pyridin-2-yl-4-thiophen-2-ylpyrazolo[3,4-b]pyridine-3-carboxamide Traditional Name: N-butyl-N-methyl-1-(2-pyridyl)-4-(2-thienyl)pyrazolo[3,4-b]pyridine-3-carboxamide Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=NN(C2=NC=CC(=C12)C3=CC=CS3)C4=CC=CC=N4

Isomeric SMILES

CCCCN(C)C(=O)C1=NN(C2=NC=CC(=C12)C3=CC=CS3)C4=CC=CC=N4

InChI

InChI=1S/C21H21N5OS/c1-3-4-13-25(2)21(27)19-18-15(16-8-7-14-28-16)10-12-23-20(18)26(24-19)17-9-5-6-11-22-17/h5-12,14H,3-4,13H2,1-2H3