N-cyclopropyl-2-methoxy-5-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-cyclopropyl-2-methoxy-5-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-cyclopropyl-2-methoxy-5-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-cyclopropyl-2-methoxy-5-[[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-cyclopropyl-2-methoxy-5-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-cyclopropyl-2-methoxy-5-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carbonyl]benzenesulfonamide Formula: C21H25N7O4S MolecularWeight: 471.5327

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)OC)S(=O)(=O)NC5CC5

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)OC)S(=O)(=O)NC5CC5

InChI

InChI=1S/C21H25N7O4S/c1-26-19-16(12-24-26)20(23-13-22-19)27-7-9-28(10-8-27)21(29)14-3-6-17(32-2)18(11-14)33(30,31)25-15-4-5-15/h3,6,11-13,15,25H,4-5,7-10H2,1-2H3