N-methyl-4-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-methyl-4-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-methyl-4-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-methyl-4-[[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-methyl-4-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-methyl-4-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carbonyl]benzenesulfonamide Formula: C18H21N7O3S MolecularWeight: 415.46944

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=NC4=C3C=NN4C

Isomeric SMILES

CNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=NC4=C3C=NN4C

InChI

InChI=1S/C18H21N7O3S/c1-19-29(27,28)14-5-3-13(4-6-14)18(26)25-9-7-24(8-10-25)17-15-11-22-23(2)16(15)20-12-21-17/h3-6,11-12,19H,7-10H2,1-2H3