2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide

Systemtic Name: 2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide Openeye Name: N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)-2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide CAS Name: 2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-[5-(4-morpholinylsulfonyl)-2-propan-2-yloxyphenyl]acetamide IUPAC Name: 2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxyphenyl)acetamide Traditional Name: N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)-2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide Formula: C21H26N6O6S MolecularWeight: 490.53274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CN3C=NC4=C(C3=O)C=NN4C

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CN3C=NC4=C(C3=O)C=NN4C

InChI

InChI=1S/C21H26N6O6S/c1-14(2)33-18-5-4-15(34(30,31)27-6-8-32-9-7-27)10-17(18)24-19(28)12-26-13-22-20-16(21(26)29)11-23-25(20)3/h4-5,10-11,13-14H,6-9,12H2,1-3H3,(H,24,28)