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

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-1-(phenylmethyl)-4-thiophen-2-yl-pyrazolo[3,4-b]pyridine-3-carboxamide Openeye Name: 1-benzyl-N-[2-(4-methoxyphenyl)ethyl]-4-(2-thienyl)pyrazolo[3,4-b]pyridine-3-carboxamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-1-(phenylmethyl)-4-thiophen-2-yl-3-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N-[2-(4-methoxyphenyl)ethyl]-4-thiophen-2-ylpyrazolo[3,4-b]pyridine-3-carboxamide Traditional Name: 1-benzyl-N-[2-(4-methoxyphenyl)ethyl]-4-(2-thienyl)pyrazolo[3,4-b]pyridine-3-carboxamide Formula: C27H24N4O2S MolecularWeight: 468.57006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2=NN(C3=NC=CC(=C23)C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)C2=NN(C3=NC=CC(=C23)C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C27H24N4O2S/c1-33-21-11-9-19(10-12-21)13-15-29-27(32)25-24-22(23-8-5-17-34-23)14-16-28-26(24)31(30-25)18-20-6-3-2-4-7-20/h2-12,14,16-17H,13,15,18H2,1H3,(H,29,32)