N-tert-butyl-2-[1-(4-methoxyphenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[1-(4-methoxyphenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]ethanamide Openeye Name: N-tert-butyl-2-[1-(4-methoxyphenyl)-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl]acetamide CAS Name: N-tert-butyl-2-[1-(4-methoxyphenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]acetamide IUPAC Name: N-tert-butyl-2-[1-(4-methoxyphenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]acetamide Traditional Name: N-tert-butyl-2-[4-keto-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-5-yl]acetamide Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1C=NC2=C(C1=O)C=NN2C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)NC(=O)CN1C=NC2=C(C1=O)C=NN2C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H21N5O3/c1-18(2,3)21-15(24)10-22-11-19-16-14(17(22)25)9-20-23(16)12-5-7-13(26-4)8-6-12/h5-9,11H,10H2,1-4H3,(H,21,24)