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

Systemtic Name: N-(2-ethoxyphenyl)-2-[[1-(2-methoxyphenyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]ethanamide Openeye Name: N-(2-ethoxyphenyl)-2-[[1-(2-methoxyphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]acetamide CAS Name: N-(2-ethoxyphenyl)-2-[[1-(2-methoxyphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]acetamide IUPAC Name: N-(2-ethoxyphenyl)-2-[[1-(2-methoxyphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]acetamide Traditional Name: 2-[[4-keto-1-(2-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-o-phenetyl-acetamide Formula: C22H21N5O4S MolecularWeight: 451.49824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4OC

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4OC

InChI

InChI=1S/C22H21N5O4S/c1-3-31-17-10-6-4-8-15(17)24-19(28)13-32-22-25-20-14(21(29)26-22)12-23-27(20)16-9-5-7-11-18(16)30-2/h4-12,23H,3,13H2,1-2H3,(H,24,28)