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

Systemtic Name: 1-(4-methyl-4-oxidanyl-piperidin-1-yl)-2-phenyl-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone Openeye Name: 1-(4-hydroxy-4-methyl-1-piperidyl)-2-phenyl-2-(4-thioxo-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone CAS Name: 1-(4-hydroxy-4-methyl-1-piperidinyl)-2-phenyl-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone IUPAC Name: 1-(4-hydroxy-4-methylpiperidin-1-yl)-2-phenyl-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone Traditional Name: 1-(4-hydroxy-4-methyl-piperidino)-2-phenyl-2-(4-thioxo-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone Formula: C19H21N5O2S MolecularWeight: 383.46734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5O2S/c1-19(26)7-9-23(10-8-19)17(25)15(13-5-3-2-4-6-13)24-12-20-16-14(18(24)27)11-21-22-16/h2-6,11-12,15,26H,7-10H2,1H3,(H,21,22)