N-cyclohexyl-2-[[1-(2-methoxyphenyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]ethanamide

Systemtic Name: N-cyclohexyl-2-[[1-(2-methoxyphenyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]ethanamide Openeye Name: N-cyclohexyl-2-[[1-(2-methoxyphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]acetamide CAS Name: N-cyclohexyl-2-[[1-(2-methoxyphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]acetamide IUPAC Name: N-cyclohexyl-2-[[1-(2-methoxyphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]acetamide Traditional Name: N-cyclohexyl-2-[[4-keto-1-(2-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]acetamide Formula: C20H23N5O3S MolecularWeight: 413.49332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C3=NC(=NC(=O)C3=CN2)SCC(=O)NC4CCCCC4

Isomeric SMILES

COC1=CC=CC=C1N2C3=NC(=NC(=O)C3=CN2)SCC(=O)NC4CCCCC4

InChI

InChI=1S/C20H23N5O3S/c1-28-16-10-6-5-9-15(16)25-18-14(11-21-25)19(27)24-20(23-18)29-12-17(26)22-13-7-3-2-4-8-13/h5-6,9-11,13,21H,2-4,7-8,12H2,1H3,(H,22,26)