3-bromanyl-N-(2-morpholin-4-ylethyl)-1-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-6-amine

Systemtic Name: 3-bromanyl-N-(2-morpholin-4-ylethyl)-1-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-6-amine Openeye Name: 1-benzyl-3-bromo-N-(2-morpholinoethyl)pyrazolo[3,4-d]pyrimidin-6-amine CAS Name: 3-bromo-N-[2-(4-morpholinyl)ethyl]-1-(phenylmethyl)-6-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-benzyl-3-bromo-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine Traditional Name: (1-benzyl-3-bromo-pyrazolo[3,4-d]pyrimidin-6-yl)-(2-morpholinoethyl)amine Formula: C18H21BrN6O MolecularWeight: 417.30294

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC2=NC=C3C(=N2)N(N=C3Br)CC4=CC=CC=C4

Isomeric SMILES

C1COCCN1CCNC2=NC=C3C(=N2)N(N=C3Br)CC4=CC=CC=C4

InChI

InChI=1S/C18H21BrN6O/c19-16-15-12-21-18(20-6-7-24-8-10-26-11-9-24)22-17(15)25(23-16)13-14-4-2-1-3-5-14/h1-5,12H,6-11,13H2,(H,20,21,22)