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

Systemtic Name: 2-methyl-N-[2-(6-methylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-methyl-N-[2-(6-methylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]thiazole-4-carboxamide CAS Name: 2-methyl-N-[2-[6-(methylthio)-4-(1-pyrrolidinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-4-thiazolecarboxamide IUPAC Name: 2-methyl-N-[2-(6-methylsulfanyl-4-pyrrolidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-methyl-N-[2-[6-(methylthio)-4-pyrrolidino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]thiazole-4-carboxamide Formula: C17H21N7OS2 MolecularWeight: 403.52494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C(=O)NCCN2C3=C(C=N2)C(=NC(=N3)SC)N4CCCC4

Isomeric SMILES

CC1=NC(=CS1)C(=O)NCCN2C3=C(C=N2)C(=NC(=N3)SC)N4CCCC4

InChI

InChI=1S/C17H21N7OS2/c1-11-20-13(10-27-11)16(25)18-5-8-24-15-12(9-19-24)14(21-17(22-15)26-2)23-6-3-4-7-23/h9-10H,3-8H2,1-2H3,(H,18,25)