N-(3-chlorophenyl)-6-morpholin-4-yl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-chlorophenyl)-6-morpholin-4-yl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(3-chlorophenyl)-6-morpholino-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(3-chlorophenyl)-6-(4-morpholinyl)-1-phenyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(3-chlorophenyl)-6-morpholin-4-yl-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (3-chlorophenyl)-(6-morpholino-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C21H19ClN6O MolecularWeight: 406.86816

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(C=NN3C4=CC=CC=C4)C(=N2)NC5=CC(=CC=C5)Cl

Isomeric SMILES

C1COCCN1C2=NC3=C(C=NN3C4=CC=CC=C4)C(=N2)NC5=CC(=CC=C5)Cl

InChI

InChI=1S/C21H19ClN6O/c22-15-5-4-6-16(13-15)24-19-18-14-23-28(17-7-2-1-3-8-17)20(18)26-21(25-19)27-9-11-29-12-10-27/h1-8,13-14H,9-12H2,(H,24,25,26)