1-tert-butyl-5-[3-[4-(diphenylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-6-methyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-tert-butyl-5-[3-[4-(diphenylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-6-methyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[3-(4-benzhydrylpiperazin-1-yl)-3-oxo-propyl]-1-tert-butyl-6-methyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-tert-butyl-5-[3-[4-(diphenylmethyl)-1-piperazinyl]-3-oxopropyl]-6-methyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[3-(4-benzhydrylpiperazin-1-yl)-3-oxopropyl]-1-tert-butyl-6-methylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[3-(4-benzhydrylpiperazino)-3-keto-propyl]-1-tert-butyl-6-methyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C30H36N6O2 MolecularWeight: 512.64584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C(C)(C)C)C(=O)N1CCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=C(C=NN2C(C)(C)C)C(=O)N1CCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H36N6O2/c1-22-32-28-25(21-31-36(28)30(2,3)4)29(38)35(22)16-15-26(37)33-17-19-34(20-18-33)27(23-11-7-5-8-12-23)24-13-9-6-10-14-24/h5-14,21,27H,15-20H2,1-4H3