[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-fluoranyl-4-methoxy-phenyl)methanone

Systemtic Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-fluoranyl-4-methoxy-phenyl)methanone Openeye Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-fluoro-4-methoxy-phenyl)methanone CAS Name: [4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-(3-fluoro-4-methoxyphenyl)methanone IUPAC Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-fluoro-4-methoxyphenyl)methanone Traditional Name: [4-(2,5-dimethylphenyl)sulfonylpiperazino]-(3-fluoro-4-methoxy-phenyl)methanone Formula: C20H23FN2O4S MolecularWeight: 406.471023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C20H23FN2O4S/c1-14-4-5-15(2)19(12-14)28(25,26)23-10-8-22(9-11-23)20(24)16-6-7-18(27-3)17(21)13-16/h4-7,12-13H,8-11H2,1-3H3