[4-(5-tert-butyl-2-methyl-phenyl)sulfonylpiperazin-1-yl]-(2-fluorophenyl)methanone

Systemtic Name: [4-(5-tert-butyl-2-methyl-phenyl)sulfonylpiperazin-1-yl]-(2-fluorophenyl)methanone Openeye Name: [4-(5-tert-butyl-2-methyl-phenyl)sulfonylpiperazin-1-yl]-(2-fluorophenyl)methanone CAS Name: [4-(5-tert-butyl-2-methylphenyl)sulfonyl-1-piperazinyl]-(2-fluorophenyl)methanone IUPAC Name: [4-(5-tert-butyl-2-methylphenyl)sulfonylpiperazin-1-yl]-(2-fluorophenyl)methanone Traditional Name: [4-(5-tert-butyl-2-methyl-phenyl)sulfonylpiperazino]-(2-fluorophenyl)methanone Formula: C22H27FN2O3S MolecularWeight: 418.524783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H27FN2O3S/c1-16-9-10-17(22(2,3)4)15-20(16)29(27,28)25-13-11-24(12-14-25)21(26)18-7-5-6-8-19(18)23/h5-10,15H,11-14H2,1-4H3