N-[5-(diethylamino)pentan-2-yl]-1-(phenylmethyl)-4-thiophen-2-yl-pyrazolo[3,4-b]pyridine-3-carboxamide

Systemtic Name: N-[5-(diethylamino)pentan-2-yl]-1-(phenylmethyl)-4-thiophen-2-yl-pyrazolo[3,4-b]pyridine-3-carboxamide Openeye Name: 1-benzyl-N-[4-(diethylamino)-1-methyl-butyl]-4-(2-thienyl)pyrazolo[3,4-b]pyridine-3-carboxamide CAS Name: N-[5-(diethylamino)pentan-2-yl]-1-(phenylmethyl)-4-thiophen-2-yl-3-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N-[5-(diethylamino)pentan-2-yl]-4-thiophen-2-ylpyrazolo[3,4-b]pyridine-3-carboxamide Traditional Name: 1-benzyl-N-[4-(diethylamino)-1-methyl-butyl]-4-(2-thienyl)pyrazolo[3,4-b]pyridine-3-carboxamide Formula: C27H33N5OS MolecularWeight: 475.64882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33N5OS/c1-4-31(5-2)17-9-11-20(3)29-27(33)25-24-22(23-14-10-18-34-23)15-16-28-26(24)32(30-25)19-21-12-7-6-8-13-21/h6-8,10,12-16,18,20H,4-5,9,11,17,19H2,1-3H3,(H,29,33)