N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(2-ethynyl-3-trimethylsilyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(2-ethynyl-3-trimethylsilyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(2-ethynyl-3-trimethylsilyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(2-ethynyl-3-trimethylsilylphenyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(2-ethynyl-3-trimethylsilylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[1-(2-ethynyl-3-trimethylsilyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C25H25N5O2Si MolecularWeight: 455.5838

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Descriptors Computed from Structure

Canonical SMILES:

C[Si](C)(C)C1=CC=CC(=C1C#C)N2C3=C(C=N2)C(=NC=N3)NCC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C[Si](C)(C)C1=CC=CC(=C1C#C)N2C3=C(C=N2)C(=NC=N3)NCC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C25H25N5O2Si/c1-5-18-20(7-6-8-23(18)33(2,3)4)30-25-19(15-29-30)24(27-16-28-25)26-14-17-9-10-21-22(13-17)32-12-11-31-21/h1,6-10,13,15-16H,11-12,14H2,2-4H3,(H,26,27,28)