3-[[4-(4-morpholin-4-yl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)phenyl]amino]propanamide

Systemtic Name: 3-[[4-(4-morpholin-4-yl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)phenyl]amino]propanamide Openeye Name: 3-[4-(4-morpholino-1H-pyrazolo[3,4-d]pyrimidin-6-yl)anilino]propanamide CAS Name: 3-[4-[4-(4-morpholinyl)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]anilino]propanamide IUPAC Name: 3-[4-(4-morpholin-4-yl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)anilino]propanamide Traditional Name: 3-[4-(4-morpholino-1H-pyrazolo[3,4-d]pyrimidin-6-yl)anilino]propionamide Formula: C18H21N7O2 MolecularWeight: 367.40504

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=NC3=C2C=NN3)C4=CC=C(C=C4)NCCC(=O)N

Isomeric SMILES

C1COCCN1C2=NC(=NC3=C2C=NN3)C4=CC=C(C=C4)NCCC(=O)N

InChI

InChI=1S/C18H21N7O2/c19-15(26)5-6-20-13-3-1-12(2-4-13)16-22-17-14(11-21-24-17)18(23-16)25-7-9-27-10-8-25/h1-4,11,20H,5-10H2,(H2,19,26)(H,21,22,23,24)