2-phenyl-1-(4-phenylpiperazin-1-yl)-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone

Systemtic Name: 2-phenyl-1-(4-phenylpiperazin-1-yl)-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone Openeye Name: 2-phenyl-1-(4-phenylpiperazin-1-yl)-2-(4-thioxo-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone CAS Name: 2-phenyl-1-(4-phenyl-1-piperazinyl)-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone IUPAC Name: 2-phenyl-1-(4-phenylpiperazin-1-yl)-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone Traditional Name: 2-phenyl-1-(4-phenylpiperazino)-2-(4-thioxo-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone Formula: C23H22N6OS MolecularWeight: 430.52538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C(C3=CC=CC=C3)N4C=NC5=C(C4=S)C=NN5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C(C3=CC=CC=C3)N4C=NC5=C(C4=S)C=NN5

InChI

InChI=1S/C23H22N6OS/c30-22(28-13-11-27(12-14-28)18-9-5-2-6-10-18)20(17-7-3-1-4-8-17)29-16-24-21-19(23(29)31)15-25-26-21/h1-10,15-16,20H,11-14H2,(H,25,26)