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

Systemtic Name: 1-(4-ethanoyl-4-phenyl-piperidin-1-yl)-2-phenyl-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone Openeye Name: 1-(4-acetyl-4-phenyl-1-piperidyl)-2-phenyl-2-(4-thioxo-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone CAS Name: 1-(4-acetyl-4-phenyl-1-piperidinyl)-2-phenyl-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone IUPAC Name: 1-(4-acetyl-4-phenylpiperidin-1-yl)-2-phenyl-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone Traditional Name: 1-(4-acetyl-4-phenyl-piperidino)-2-phenyl-2-(4-thioxo-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone Formula: C26H25N5O2S MolecularWeight: 471.574

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CCN(CC1)C(=O)C(C2=CC=CC=C2)N3C=NC4=C(C3=S)C=NN4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)C1(CCN(CC1)C(=O)C(C2=CC=CC=C2)N3C=NC4=C(C3=S)C=NN4)C5=CC=CC=C5

InChI

InChI=1S/C26H25N5O2S/c1-18(32)26(20-10-6-3-7-11-20)12-14-30(15-13-26)24(33)22(19-8-4-2-5-9-19)31-17-27-23-21(25(31)34)16-28-29-23/h2-11,16-17,22H,12-15H2,1H3,(H,28,29)