2-[4-(2-methyl-3,5-diphenyl-pyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(2-methyl-3,5-diphenyl-pyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]ethanenitrile Openeye Name: 2-[4-(2-methyl-3,5-diphenyl-pyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]acetonitrile CAS Name: 2-[4-(2-methyl-3,5-diphenyl-7-pyrazolo[1,5-a]pyrimidinyl)-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-(2-methyl-3,5-diphenylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]acetonitrile Traditional Name: 2-[4-(2-methyl-3,5-diphenyl-pyrazolo[1,5-a]pyrimidin-7-yl)piperazino]acetonitrile Formula: C25H24N6 MolecularWeight: 408.49826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C(=CC(=NC2=C1C3=CC=CC=C3)C4=CC=CC=C4)N5CCN(CC5)CC#N

Isomeric SMILES

CC1=NN2C(=CC(=NC2=C1C3=CC=CC=C3)C4=CC=CC=C4)N5CCN(CC5)CC#N

InChI

InChI=1S/C25H24N6/c1-19-24(21-10-6-3-7-11-21)25-27-22(20-8-4-2-5-9-20)18-23(31(25)28-19)30-16-14-29(13-12-26)15-17-30/h2-11,18H,13-17H2,1H3