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

Systemtic Name: 2-methyl-N-[2-[4-(propylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]quinoline-8-sulfonamide Openeye Name: 2-methyl-N-[2-[4-(propylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]quinoline-8-sulfonamide CAS Name: 2-methyl-N-[2-[4-(propylamino)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-8-quinolinesulfonamide IUPAC Name: 2-methyl-N-[2-[4-(propylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]quinoline-8-sulfonamide Traditional Name: 2-methyl-N-[2-[4-(propylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]quinoline-8-sulfonamide Formula: C20H23N7O2S MolecularWeight: 425.50732

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC=NC2=C1C=NN2CCNS(=O)(=O)C3=CC=CC4=C3N=C(C=C4)C

Isomeric SMILES

CCCNC1=NC=NC2=C1C=NN2CCNS(=O)(=O)C3=CC=CC4=C3N=C(C=C4)C

InChI

InChI=1S/C20H23N7O2S/c1-3-9-21-19-16-12-24-27(20(16)23-13-22-19)11-10-25-30(28,29)17-6-4-5-15-8-7-14(2)26-18(15)17/h4-8,12-13,25H,3,9-11H2,1-2H3,(H,21,22,23)