1-[4-(diphenylmethyl)piperazin-1-yl]-1-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanyl)propan-2-ol

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-1-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanyl)propan-2-ol Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-1-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanyl)propan-2-ol CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-1-(1H-pyrazolo[3,4-d]pyrimidin-4-ylthio)-2-propanol IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-1-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanyl)propan-2-ol Traditional Name: 1-(4-benzhydrylpiperazino)-1-(1H-pyrazolo[3,4-d]pyrimidin-4-ylthio)propan-2-ol Formula: C25H28N6OS MolecularWeight: 460.59442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)SC4=NC=NC5=C4C=NN5)O

Isomeric SMILES

CC(C(N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)SC4=NC=NC5=C4C=NN5)O

InChI

InChI=1S/C25H28N6OS/c1-18(32)25(33-24-21-16-28-29-23(21)26-17-27-24)31-14-12-30(13-15-31)22(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,16-18,22,25,32H,12-15H2,1H3,(H,26,27,28,29)