N-[2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-2-fluoranyl-benzamide

Systemtic Name: N-[2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-2-fluoranyl-benzamide Openeye Name: N-[2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-2-fluoro-benzamide CAS Name: N-[2-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-2-fluorobenzamide IUPAC Name: N-[2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-2-fluorobenzamide Traditional Name: 2-fluoro-N-[2-keto-2-(4-p-phenetylsulfonylpiperazino)ethyl]benzamide Formula: C21H24FN3O5S MolecularWeight: 449.495763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CNC(=O)C3=CC=CC=C3F

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CNC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H24FN3O5S/c1-2-30-16-7-9-17(10-8-16)31(28,29)25-13-11-24(12-14-25)20(26)15-23-21(27)18-5-3-4-6-19(18)22/h3-10H,2,11-15H2,1H3,(H,23,27)