7-cyclopentyl-2-[(6-fluoranylpyridin-3-yl)methyl]-5-methyl-3-phenylazanyl-4-sulfanylidene-pyrazolo[3,4-d]pyrimidin-6-one

Systemtic Name: 7-cyclopentyl-2-[(6-fluoranylpyridin-3-yl)methyl]-5-methyl-3-phenylazanyl-4-sulfanylidene-pyrazolo[3,4-d]pyrimidin-6-one Openeye Name: 3-anilino-7-cyclopentyl-2-[(6-fluoro-3-pyridyl)methyl]-5-methyl-4-thioxo-pyrazolo[3,4-d]pyrimidin-6-one CAS Name: 3-anilino-7-cyclopentyl-2-[(6-fluoro-3-pyridinyl)methyl]-5-methyl-4-sulfanylidene-6-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 3-anilino-7-cyclopentyl-2-[(6-fluoropyridin-3-yl)methyl]-5-methyl-4-sulfanylidenepyrazolo[3,4-d]pyrimidin-6-one Traditional Name: 3-anilino-7-cyclopentyl-2-[(6-fluoro-3-pyridyl)methyl]-5-methyl-4-thioxo-pyrazolo[3,4-d]pyrimidin-6-one Formula: C23H23FN6OS MolecularWeight: 450.531723

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=S)C2=C(N(N=C2N(C1=O)C3CCCC3)CC4=CN=C(C=C4)F)NC5=CC=CC=C5

Isomeric SMILES

CN1C(=S)C2=C(N(N=C2N(C1=O)C3CCCC3)CC4=CN=C(C=C4)F)NC5=CC=CC=C5

InChI

InChI=1S/C23H23FN6OS/c1-28-22(32)19-20(26-16-7-3-2-4-8-16)29(14-15-11-12-18(24)25-13-15)27-21(19)30(23(28)31)17-9-5-6-10-17/h2-4,7-8,11-13,17,26H,5-6,9-10,14H2,1H3