5-methyl-7-(2-methylprop-2-enyl)-2-(naphthalen-1-ylmethyl)-3-pyridin-2-ylsulfanyl-pyrazolo[3,4-d]pyrimidine-4,6-dione

Systemtic Name: 5-methyl-7-(2-methylprop-2-enyl)-2-(naphthalen-1-ylmethyl)-3-pyridin-2-ylsulfanyl-pyrazolo[3,4-d]pyrimidine-4,6-dione Openeye Name: 5-methyl-7-(2-methylallyl)-2-(1-naphthylmethyl)-3-(2-pyridylsulfanyl)pyrazolo[3,4-d]pyrimidine-4,6-dione CAS Name: 5-methyl-7-(2-methylprop-2-enyl)-2-(1-naphthalenylmethyl)-3-(2-pyridinylthio)pyrazolo[3,4-d]pyrimidine-4,6-dione IUPAC Name: 5-methyl-7-(2-methylprop-2-enyl)-2-(naphthalen-1-ylmethyl)-3-pyridin-2-ylsulfanylpyrazolo[3,4-d]pyrimidine-4,6-dione Traditional Name: 5-methyl-7-(2-methylallyl)-2-(1-naphthylmethyl)-3-(2-pyridylthio)pyrazolo[3,4-d]pyrimidine-4,6-quinone Formula: C26H23N5O2S MolecularWeight: 469.55812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN1C2=NN(C(=C2C(=O)N(C1=O)C)SC3=CC=CC=N3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC(=C)CN1C2=NN(C(=C2C(=O)N(C1=O)C)SC3=CC=CC=N3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H23N5O2S/c1-17(2)15-30-23-22(24(32)29(3)26(30)33)25(34-21-13-6-7-14-27-21)31(28-23)16-19-11-8-10-18-9-4-5-12-20(18)19/h4-14H,1,15-16H2,2-3H3