N-[4-(4-azanyl-1-piperidin-4-yl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxy-phenyl]-4-chloranyl-2-fluoranyl-benzamide

Systemtic Name: N-[4-(4-azanyl-1-piperidin-4-yl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxy-phenyl]-4-chloranyl-2-fluoranyl-benzamide Openeye Name: N-[4-[4-amino-1-(4-piperidyl)pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxy-phenyl]-4-chloro-2-fluoro-benzamide CAS Name: N-[4-[4-amino-1-(4-piperidinyl)-3-pyrazolo[3,4-d]pyrimidinyl]-2-methoxyphenyl]-4-chloro-2-fluorobenzamide IUPAC Name: N-[4-(4-amino-1-piperidin-4-ylpyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxyphenyl]-4-chloro-2-fluorobenzamide Traditional Name: N-[4-[4-amino-1-(4-piperidyl)pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxy-phenyl]-4-chloro-2-fluoro-benzamide Formula: C24H23ClFN7O2 MolecularWeight: 495.936523

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=NN(C3=C2C(=NC=N3)N)C4CCNCC4)NC(=O)C5=C(C=C(C=C5)Cl)F

Isomeric SMILES

COC1=C(C=CC(=C1)C2=NN(C3=C2C(=NC=N3)N)C4CCNCC4)NC(=O)C5=C(C=C(C=C5)Cl)F

InChI

InChI=1S/C24H23ClFN7O2/c1-35-19-10-13(2-5-18(19)31-24(34)16-4-3-14(25)11-17(16)26)21-20-22(27)29-12-30-23(20)33(32-21)15-6-8-28-9-7-15/h2-5,10-12,15,28H,6-9H2,1H3,(H,31,34)(H2,27,29,30)