4-[2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]ethoxy]benzenesulfonamide

Systemtic Name: 4-[2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]ethoxy]benzenesulfonamide Openeye Name: 4-[2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]ethoxy]benzenesulfonamide CAS Name: 4-[2-[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]ethoxy]benzenesulfonamide Traditional Name: 4-[2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]ethoxy]benzenesulfonamide Formula: C18H23N7O3S MolecularWeight: 417.48532

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CCOC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CCOC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C18H23N7O3S/c1-23-17-16(12-22-23)18(21-13-20-17)25-8-6-24(7-9-25)10-11-28-14-2-4-15(5-3-14)29(19,26)27/h2-5,12-13H,6-11H2,1H3,(H2,19,26,27)