[2-(cyclopropylmethoxy)-5-methylsulfonyl-phenyl]-[4-(2-fluoranyl-4-methylsulfonyl-phenyl)piperazin-1-yl]methanone

Systemtic Name: [2-(cyclopropylmethoxy)-5-methylsulfonyl-phenyl]-[4-(2-fluoranyl-4-methylsulfonyl-phenyl)piperazin-1-yl]methanone Openeye Name: [2-(cyclopropylmethoxy)-5-methylsulfonyl-phenyl]-[4-(2-fluoro-4-methylsulfonyl-phenyl)piperazin-1-yl]methanone CAS Name: [2-(cyclopropylmethoxy)-5-methylsulfonylphenyl]-[4-(2-fluoro-4-methylsulfonylphenyl)-1-piperazinyl]methanone IUPAC Name: [2-(cyclopropylmethoxy)-5-methylsulfonylphenyl]-[4-(2-fluoro-4-methylsulfonylphenyl)piperazin-1-yl]methanone Traditional Name: [2-(cyclopropylmethoxy)-5-mesyl-phenyl]-[4-(2-fluoro-4-mesyl-phenyl)piperazino]methanone Formula: C23H27FN2O6S2 MolecularWeight: 510.598683

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)OCC2CC2)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)S(=O)(=O)C)F

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)OCC2CC2)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)S(=O)(=O)C)F

InChI

InChI=1S/C23H27FN2O6S2/c1-33(28,29)17-6-8-22(32-15-16-3-4-16)19(13-17)23(27)26-11-9-25(10-12-26)21-7-5-18(14-20(21)24)34(2,30)31/h5-8,13-14,16H,3-4,9-12,15H2,1-2H3