5-methyl-7-phenyl-2-[4-(phenylmethyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile

Systemtic Name: 5-methyl-7-phenyl-2-[4-(phenylmethyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile Openeye Name: 2-(4-benzylpiperazin-1-yl)-5-methyl-7-phenyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile CAS Name: 5-methyl-7-phenyl-2-[4-(phenylmethyl)-1-piperazinyl]-3-pyrazolo[1,5-a]pyrimidinecarbonitrile IUPAC Name: 2-(4-benzylpiperazin-1-yl)-5-methyl-7-phenylpyrazolo[1,5-a]pyrimidine-3-carbonitrile Traditional Name: 2-(4-benzylpiperazino)-5-methyl-7-phenyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Formula: C25H24N6 MolecularWeight: 408.49826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C(=C1)C3=CC=CC=C3)N4CCN(CC4)CC5=CC=CC=C5)C#N

Isomeric SMILES

CC1=NC2=C(C(=NN2C(=C1)C3=CC=CC=C3)N4CCN(CC4)CC5=CC=CC=C5)C#N

InChI

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