2-methyl-N-[2-(6-methylsulfanyl-4-morpholin-4-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-methyl-N-[2-(6-methylsulfanyl-4-morpholin-4-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-methyl-N-[2-(6-methylsulfanyl-4-morpholino-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]thiazole-4-carboxamide CAS Name: 2-methyl-N-[2-[6-(methylthio)-4-(4-morpholinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-4-thiazolecarboxamide IUPAC Name: 2-methyl-N-[2-(6-methylsulfanyl-4-morpholin-4-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-methyl-N-[2-[6-(methylthio)-4-morpholino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]thiazole-4-carboxamide Formula: C17H21N7O2S2 MolecularWeight: 419.52434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C(=O)NCCN2C3=C(C=N2)C(=NC(=N3)SC)N4CCOCC4

Isomeric SMILES

CC1=NC(=CS1)C(=O)NCCN2C3=C(C=N2)C(=NC(=N3)SC)N4CCOCC4

InChI

InChI=1S/C17H21N7O2S2/c1-11-20-13(10-28-11)16(25)18-3-4-24-15-12(9-19-24)14(21-17(22-15)27-2)23-5-7-26-8-6-23/h9-10H,3-8H2,1-2H3,(H,18,25)