N-(2,5-dimethoxyphenyl)-N-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]methanesulfonamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-N-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]methanesulfonamide Openeye Name: N-(2,5-dimethoxyphenyl)-N-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]methanesulfonamide CAS Name: N-(2,5-dimethoxyphenyl)-N-[2-[4-(2-fluorophenyl)-1-piperazinyl]-2-oxoethyl]methanesulfonamide IUPAC Name: N-(2,5-dimethoxyphenyl)-N-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl]methanesulfonamide Traditional Name: N-(2,5-dimethoxyphenyl)-N-[2-[4-(2-fluorophenyl)piperazino]-2-keto-ethyl]methanesulfonamide Formula: C21H26FN3O5S MolecularWeight: 451.511643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N(CC(=O)N2CCN(CC2)C3=CC=CC=C3F)S(=O)(=O)C

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N(CC(=O)N2CCN(CC2)C3=CC=CC=C3F)S(=O)(=O)C

InChI

InChI=1S/C21H26FN3O5S/c1-29-16-8-9-20(30-2)19(14-16)25(31(3,27)28)15-21(26)24-12-10-23(11-13-24)18-7-5-4-6-17(18)22/h4-9,14H,10-13,15H2,1-3H3