[4-(4-cyclobutylsulfonyl-2-fluoranyl-phenyl)piperazin-1-yl]-(5-methylsulfonyl-2-propan-2-yloxy-phenyl)methanone

Systemtic Name: [4-(4-cyclobutylsulfonyl-2-fluoranyl-phenyl)piperazin-1-yl]-(5-methylsulfonyl-2-propan-2-yloxy-phenyl)methanone Openeye Name: [4-(4-cyclobutylsulfonyl-2-fluoro-phenyl)piperazin-1-yl]-(2-isopropoxy-5-methylsulfonyl-phenyl)methanone CAS Name: [4-(4-cyclobutylsulfonyl-2-fluorophenyl)-1-piperazinyl]-(5-methylsulfonyl-2-propan-2-yloxyphenyl)methanone IUPAC Name: [4-(4-cyclobutylsulfonyl-2-fluorophenyl)piperazin-1-yl]-(5-methylsulfonyl-2-propan-2-yloxyphenyl)methanone Traditional Name: [4-(4-cyclobutylsulfonyl-2-fluoro-phenyl)piperazino]-(2-isopropoxy-5-mesyl-phenyl)methanone Formula: C25H31FN2O6S2 MolecularWeight: 538.651843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C4CCC4)F

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C4CCC4)F

InChI

InChI=1S/C25H31FN2O6S2/c1-17(2)34-24-10-8-19(35(3,30)31)15-21(24)25(29)28-13-11-27(12-14-28)23-9-7-20(16-22(23)26)36(32,33)18-5-4-6-18/h7-10,15-18H,4-6,11-14H2,1-3H3