2-[3-bromanyl-5-[[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)-methyl-amino]methyl]-1-benzofuran-2-yl]benzenecarbonitrile

Systemtic Name: 2-[3-bromanyl-5-[[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)-methyl-amino]methyl]-1-benzofuran-2-yl]benzenecarbonitrile Openeye Name: 2-[3-bromo-5-[[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)-methyl-amino]methyl]benzofuran-2-yl]benzonitrile CAS Name: 2-[3-bromo-5-[[(5-ethyl-7-pyrazolo[1,5-a]pyrimidinyl)-methylamino]methyl]-2-benzofuranyl]benzonitrile IUPAC Name: 2-[3-bromo-5-[[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)-methylamino]methyl]-1-benzofuran-2-yl]benzonitrile Traditional Name: 2-[3-bromo-5-[[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)-methyl-amino]methyl]benzofuran-2-yl]benzonitrile Formula: C25H20BrN5O MolecularWeight: 486.3632

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=NN2C(=C1)N(C)CC3=CC4=C(C=C3)OC(=C4Br)C5=CC=CC=C5C#N

Isomeric SMILES

CCC1=NC2=CC=NN2C(=C1)N(C)CC3=CC4=C(C=C3)OC(=C4Br)C5=CC=CC=C5C#N

InChI

InChI=1S/C25H20BrN5O/c1-3-18-13-23(31-22(29-18)10-11-28-31)30(2)15-16-8-9-21-20(12-16)24(26)25(32-21)19-7-5-4-6-17(19)14-27/h4-13H,3,15H2,1-2H3