2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-morpholin-4-yl-ethanone

Systemtic Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-morpholin-4-yl-ethanone Openeye Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-morpholino-ethanone CAS Name: 2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-1-(4-morpholinyl)ethanone IUPAC Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-morpholin-4-ylethanone Traditional Name: 2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]-1-morpholino-ethanone Formula: C12H15N5O2S MolecularWeight: 293.3448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)N3CCOCC3

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)N3CCOCC3

InChI

InChI=1S/C12H15N5O2S/c1-16-11-9(6-15-16)12(14-8-13-11)20-7-10(18)17-2-4-19-5-3-17/h6,8H,2-5,7H2,1H3