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

Systemtic Name: 2-methyl-N-[2-(4-pyrrolidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]quinoline-8-sulfonamide Openeye Name: 2-methyl-N-[2-(4-pyrrolidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]quinoline-8-sulfonamide CAS Name: 2-methyl-N-[2-[4-(1-pyrrolidinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-8-quinolinesulfonamide IUPAC Name: 2-methyl-N-[2-(4-pyrrolidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]quinoline-8-sulfonamide Traditional Name: 2-methyl-N-[2-(4-pyrrolidinopyrazolo[3,4-d]pyrimidin-1-yl)ethyl]quinoline-8-sulfonamide Formula: C21H23N7O2S MolecularWeight: 437.51802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2S(=O)(=O)NCCN3C4=C(C=N3)C(=NC=N4)N5CCCC5)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2S(=O)(=O)NCCN3C4=C(C=N3)C(=NC=N4)N5CCCC5)C=C1

InChI

InChI=1S/C21H23N7O2S/c1-15-7-8-16-5-4-6-18(19(16)26-15)31(29,30)25-9-12-28-21-17(13-24-28)20(22-14-23-21)27-10-2-3-11-27/h4-8,13-14,25H,2-3,9-12H2,1H3