4-fluoranyl-3-methyl-N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-3-methyl-N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]benzenesulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-1-methyl-2-(2-thienyl)ethyl]-4-fluoro-3-methyl-benzenesulfonamide CAS Name: 4-fluoro-3-methyl-N-[1-[4-(phenylmethyl)-1-piperazinyl]-1-thiophen-2-ylpropan-2-yl]benzenesulfonamide IUPAC Name: N-[1-(4-benzylpiperazin-1-yl)-1-thiophen-2-ylpropan-2-yl]-4-fluoro-3-methylbenzenesulfonamide Traditional Name: N-[2-(4-benzylpiperazino)-1-methyl-2-(2-thienyl)ethyl]-4-fluoro-3-methyl-benzenesulfonamide Formula: C25H30FN3O2S2 MolecularWeight: 487.653003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NC(C)C(C2=CC=CS2)N3CCN(CC3)CC4=CC=CC=C4)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NC(C)C(C2=CC=CS2)N3CCN(CC3)CC4=CC=CC=C4)F

InChI

InChI=1S/C25H30FN3O2S2/c1-19-17-22(10-11-23(19)26)33(30,31)27-20(2)25(24-9-6-16-32-24)29-14-12-28(13-15-29)18-21-7-4-3-5-8-21/h3-11,16-17,20,25,27H,12-15,18H2,1-2H3