N,N-diethyl-1-(phenylmethyl)-4-thiophen-2-yl-pyrazolo[3,4-b]pyridine-3-carboxamide

Systemtic Name: N,N-diethyl-1-(phenylmethyl)-4-thiophen-2-yl-pyrazolo[3,4-b]pyridine-3-carboxamide Openeye Name: 1-benzyl-N,N-diethyl-4-(2-thienyl)pyrazolo[3,4-b]pyridine-3-carboxamide CAS Name: N,N-diethyl-1-(phenylmethyl)-4-thiophen-2-yl-3-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N,N-diethyl-4-thiophen-2-ylpyrazolo[3,4-b]pyridine-3-carboxamide Traditional Name: 1-benzyl-N,N-diethyl-4-(2-thienyl)pyrazolo[3,4-b]pyridine-3-carboxamide Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=NN(C2=NC=CC(=C12)C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

CCN(CC)C(=O)C1=NN(C2=NC=CC(=C12)C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C22H22N4OS/c1-3-25(4-2)22(27)20-19-17(18-11-8-14-28-18)12-13-23-21(19)26(24-20)15-16-9-6-5-7-10-16/h5-14H,3-4,15H2,1-2H3