N-ethyl-3-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]carbonyl-4-methyl-benzenesulfonamide

Systemtic Name: N-ethyl-3-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]carbonyl-4-methyl-benzenesulfonamide Openeye Name: N-ethyl-3-[4-(3-fluorobenzoyl)piperazine-1-carbonyl]-4-methyl-benzenesulfonamide CAS Name: N-ethyl-3-[[4-[(3-fluorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-4-methylbenzenesulfonamide IUPAC Name: N-ethyl-3-[4-(3-fluorobenzoyl)piperazine-1-carbonyl]-4-methylbenzenesulfonamide Traditional Name: N-ethyl-3-[4-(3-fluorobenzoyl)piperazine-1-carbonyl]-4-methyl-benzenesulfonamide Formula: C21H24FN3O4S MolecularWeight: 433.496363

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Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C21H24FN3O4S/c1-3-23-30(28,29)18-8-7-15(2)19(14-18)21(27)25-11-9-24(10-12-25)20(26)16-5-4-6-17(22)13-16/h4-8,13-14,23H,3,9-12H2,1-2H3