4-bromanyl-N-[2-(4-morpholin-4-yl-6-propan-2-ylsulfanyl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]butanamide

Systemtic Name: 4-bromanyl-N-[2-(4-morpholin-4-yl-6-propan-2-ylsulfanyl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]butanamide Openeye Name: 4-bromo-N-[2-(6-isopropylsulfanyl-4-morpholino-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]butanamide CAS Name: 4-bromo-N-[2-[4-(4-morpholinyl)-6-(propan-2-ylthio)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]butanamide IUPAC Name: 4-bromo-N-[2-(4-morpholin-4-yl-6-propan-2-ylsulfanylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]butanamide Traditional Name: 4-bromo-N-[2-[6-(isopropylthio)-4-morpholino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]butyramide Formula: C18H27BrN6O2S MolecularWeight: 471.41498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC2=C(C=NN2CCNC(=O)CCCBr)C(=N1)N3CCOCC3

Isomeric SMILES

CC(C)SC1=NC2=C(C=NN2CCNC(=O)CCCBr)C(=N1)N3CCOCC3

InChI

InChI=1S/C18H27BrN6O2S/c1-13(2)28-18-22-16(24-8-10-27-11-9-24)14-12-21-25(17(14)23-18)7-6-20-15(26)4-3-5-19/h12-13H,3-11H2,1-2H3,(H,20,26)