(phenylmethyl) 6-methyl-4-naphthalen-1-yl-3-thiophen-2-yl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: (phenylmethyl) 6-methyl-4-naphthalen-1-yl-3-thiophen-2-yl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: benzyl 6-methyl-4-(1-naphthyl)-3-(2-thienyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 6-methyl-4-(1-naphthalenyl)-3-thiophen-2-yl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-methyl-4-naphthalen-1-yl-3-thiophen-2-yl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 6-methyl-4-(1-naphthyl)-3-(2-thienyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid benzyl ester Formula: C29H23N3O2S MolecularWeight: 477.57682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(NNC2=N1)C3=CC=CS3)C4=CC=CC5=CC=CC=C54)C(=O)OCC6=CC=CC=C6

Isomeric SMILES

CC1=C(C(C2=C(NNC2=N1)C3=CC=CS3)C4=CC=CC5=CC=CC=C54)C(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C29H23N3O2S/c1-18-24(29(33)34-17-19-9-3-2-4-10-19)25(22-14-7-12-20-11-5-6-13-21(20)22)26-27(23-15-8-16-35-23)31-32-28(26)30-18/h2-16,25H,17H2,1H3,(H2,30,31,32)