4-methyl-N-[2-(6-methylsulfanyl-4-morpholin-4-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-2-pyrrol-1-yl-1,3-thiazole-5-carboxamide

Systemtic Name: 4-methyl-N-[2-(6-methylsulfanyl-4-morpholin-4-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-2-pyrrol-1-yl-1,3-thiazole-5-carboxamide Openeye Name: 4-methyl-N-[2-(6-methylsulfanyl-4-morpholino-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-2-pyrrol-1-yl-thiazole-5-carboxamide CAS Name: 4-methyl-N-[2-[6-(methylthio)-4-(4-morpholinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-2-(1-pyrrolyl)-5-thiazolecarboxamide IUPAC Name: 4-methyl-N-[2-(6-methylsulfanyl-4-morpholin-4-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-2-pyrrol-1-yl-1,3-thiazole-5-carboxamide Traditional Name: 4-methyl-N-[2-[6-(methylthio)-4-morpholino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-2-pyrrol-1-yl-thiazole-5-carboxamide Formula: C21H24N8O2S2 MolecularWeight: 484.59766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2C=CC=C2)C(=O)NCCN3C4=C(C=N3)C(=NC(=N4)SC)N5CCOCC5

Isomeric SMILES

CC1=C(SC(=N1)N2C=CC=C2)C(=O)NCCN3C4=C(C=N3)C(=NC(=N4)SC)N5CCOCC5

InChI

InChI=1S/C21H24N8O2S2/c1-14-16(33-21(24-14)28-6-3-4-7-28)19(30)22-5-8-29-18-15(13-23-29)17(25-20(26-18)32-2)27-9-11-31-12-10-27/h3-4,6-7,13H,5,8-12H2,1-2H3,(H,22,30)