N-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-N-(4-fluorophenyl)-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-N-(4-fluorophenyl)-4-methyl-benzenesulfonamide Openeye Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-N-(4-fluorophenyl)-4-methyl-benzenesulfonamide CAS Name: N-[2-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-oxoethyl]-N-(4-fluorophenyl)-4-methylbenzenesulfonamide IUPAC Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxoethyl]-N-(4-fluorophenyl)-4-methylbenzenesulfonamide Traditional Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-keto-ethyl]-N-(4-fluorophenyl)-4-methyl-benzenesulfonamide Formula: C32H33FN3O3S+ MolecularWeight: 558.686123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C32H32FN3O3S/c1-25-12-18-30(19-13-25)40(38,39)36(29-16-14-28(33)15-17-29)24-31(37)34-20-22-35(23-21-34)32(26-8-4-2-5-9-26)27-10-6-3-7-11-27/h2-19,32H,20-24H2,1H3/p+1