2-chloranyl-N,N-diethyl-5-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 2-chloranyl-N,N-diethyl-5-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 2-chloro-N,N-diethyl-5-[4-(4-fluorophenyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: 2-chloro-N,N-diethyl-5-[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: 2-chloro-N,N-diethyl-5-[4-(4-fluorophenyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: 2-chloro-N,N-diethyl-5-[4-(4-fluorophenyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C21H25ClFN3O3S MolecularWeight: 453.957903

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C21H25ClFN3O3S/c1-3-26(4-2)30(28,29)20-15-16(5-10-19(20)22)21(27)25-13-11-24(12-14-25)18-8-6-17(23)7-9-18/h5-10,15H,3-4,11-14H2,1-2H3