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

Systemtic Name: 2-phenyl-1-(4-phenylpiperidin-1-yl)-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone Openeye Name: 2-phenyl-1-(4-phenyl-1-piperidyl)-2-(4-thioxo-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone CAS Name: 2-phenyl-1-(4-phenyl-1-piperidinyl)-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone IUPAC Name: 2-phenyl-1-(4-phenylpiperidin-1-yl)-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone Traditional Name: 2-phenyl-1-(4-phenylpiperidino)-2-(4-thioxo-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone Formula: C24H23N5OS MolecularWeight: 429.53732

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=CC=C2)C(=O)C(C3=CC=CC=C3)N4C=NC5=C(C4=S)C=NN5

Isomeric SMILES

C1CN(CCC1C2=CC=CC=C2)C(=O)C(C3=CC=CC=C3)N4C=NC5=C(C4=S)C=NN5

InChI

InChI=1S/C24H23N5OS/c30-23(28-13-11-18(12-14-28)17-7-3-1-4-8-17)21(19-9-5-2-6-10-19)29-16-25-22-20(24(29)31)15-26-27-22/h1-10,15-16,18,21H,11-14H2,(H,26,27)