1-[(2S)-2-methylmorpholin-4-yl]-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-[(2S)-2-methylmorpholin-4-yl]-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-[(2S)-2-methylmorpholin-4-yl]-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-[(2S)-2-methyl-4-morpholinyl]-2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]ethanone IUPAC Name: 1-[(2S)-2-methylmorpholin-4-yl]-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanone Traditional Name: 1-[(2S)-2-methylmorpholino]-2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]ethanone Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCO1)C(=O)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

C[C@H]1CN(CCO1)C(=O)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

InChI=1S/C18H19N5O2S/c1-13-10-22(7-8-25-13)16(24)11-26-18-15-9-21-23(17(15)19-12-20-18)14-5-3-2-4-6-14/h2-6,9,12-13H,7-8,10-11H2,1H3/t13-/m0/s1