2-[1-(4-fluorophenyl)-2-methyl-propan-2-yl]-4-methoxy-3-piperazin-1-yl-benzenesulfonamide

Systemtic Name: 2-[1-(4-fluorophenyl)-2-methyl-propan-2-yl]-4-methoxy-3-piperazin-1-yl-benzenesulfonamide Openeye Name: 2-[2-(4-fluorophenyl)-1,1-dimethyl-ethyl]-4-methoxy-3-piperazin-1-yl-benzenesulfonamide CAS Name: 2-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-4-methoxy-3-(1-piperazinyl)benzenesulfonamide IUPAC Name: 2-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-4-methoxy-3-piperazin-1-ylbenzenesulfonamide Traditional Name: 2-[2-(4-fluorophenyl)-1,1-dimethyl-ethyl]-4-methoxy-3-piperazino-benzenesulfonamide Formula: C21H28FN3O3S MolecularWeight: 421.528723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=C(C=C1)F)C2=C(C=CC(=C2N3CCNCC3)OC)S(=O)(=O)N

Isomeric SMILES

CC(C)(CC1=CC=C(C=C1)F)C2=C(C=CC(=C2N3CCNCC3)OC)S(=O)(=O)N

InChI

InChI=1S/C21H28FN3O3S/c1-21(2,14-15-4-6-16(22)7-5-15)19-18(29(23,26)27)9-8-17(28-3)20(19)25-12-10-24-11-13-25/h4-9,24H,10-14H2,1-3H3,(H2,23,26,27)