[4-[[9-(6-methylsulfonylpyridin-3-yl)-7,8-dihydropurin-6-yl]oxy]piperidin-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [4-[[9-(6-methylsulfonylpyridin-3-yl)-7,8-dihydropurin-6-yl]oxy]piperidin-1-yl]-pyridin-3-yl-methanone Openeye Name: [4-[[9-(6-methylsulfonyl-3-pyridyl)-7,8-dihydropurin-6-yl]oxy]-1-piperidyl]-(3-pyridyl)methanone CAS Name: [4-[[9-(6-methylsulfonyl-3-pyridinyl)-7,8-dihydropurin-6-yl]oxy]-1-piperidinyl]-(3-pyridinyl)methanone IUPAC Name: [4-[[9-(6-methylsulfonylpyridin-3-yl)-7,8-dihydropurin-6-yl]oxy]piperidin-1-yl]-pyridin-3-ylmethanone Traditional Name: [4-[[9-(6-mesyl-3-pyridyl)-7,8-dihydropurin-6-yl]oxy]piperidino]-(3-pyridyl)methanone Formula: C22H23N7O4S MolecularWeight: 481.52752

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(C=C1)N2CNC3=C2N=CN=C3OC4CCN(CC4)C(=O)C5=CN=CC=C5

Isomeric SMILES

CS(=O)(=O)C1=NC=C(C=C1)N2CNC3=C2N=CN=C3OC4CCN(CC4)C(=O)C5=CN=CC=C5

InChI

InChI=1S/C22H23N7O4S/c1-34(31,32)18-5-4-16(12-24-18)29-14-27-19-20(29)25-13-26-21(19)33-17-6-9-28(10-7-17)22(30)15-3-2-8-23-11-15/h2-5,8,11-13,17,27H,6-7,9-10,14H2,1H3