naphthalen-1-ylmethyl 3-methyl-1-phenyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: naphthalen-1-ylmethyl 3-methyl-1-phenyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: 1-naphthylmethyl 3-methyl-1-phenyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 3-methyl-1-phenyl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 3-methyl-1-phenyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 3-methyl-1-phenyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid 1-naphthylmethyl ester Formula: C29H21N3O2S MolecularWeight: 475.56094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CS3)C(=O)OCC4=CC=CC5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CS3)C(=O)OCC4=CC=CC5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C29H21N3O2S/c1-19-27-24(29(33)34-18-21-11-7-10-20-9-5-6-14-23(20)21)17-25(26-15-8-16-35-26)30-28(27)32(31-19)22-12-3-2-4-13-22/h2-17H,18H2,1H3