N-[2-(4-morpholin-4-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]quinoline-8-sulfonamide

Systemtic Name: N-[2-(4-morpholin-4-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]quinoline-8-sulfonamide Openeye Name: N-[2-(4-morpholinopyrazolo[3,4-d]pyrimidin-1-yl)ethyl]quinoline-8-sulfonamide CAS Name: N-[2-[4-(4-morpholinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-8-quinolinesulfonamide IUPAC Name: N-[2-(4-morpholin-4-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]quinoline-8-sulfonamide Traditional Name: N-[2-(4-morpholinopyrazolo[3,4-d]pyrimidin-1-yl)ethyl]quinoline-8-sulfonamide Formula: C20H21N7O3S MolecularWeight: 439.49084

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=NC3=C2C=NN3CCNS(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1COCCN1C2=NC=NC3=C2C=NN3CCNS(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C20H21N7O3S/c28-31(29,17-5-1-3-15-4-2-6-21-18(15)17)25-7-8-27-20-16(13-24-27)19(22-14-23-20)26-9-11-30-12-10-26/h1-6,13-14,25H,7-12H2