N,N-diethyl-3-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]carbonyl-4-methyl-benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]carbonyl-4-methyl-benzenesulfonamide Openeye Name: N,N-diethyl-3-[4-[(2-fluorophenyl)methyl]piperazine-1-carbonyl]-4-methyl-benzenesulfonamide CAS Name: N,N-diethyl-3-[[4-[(2-fluorophenyl)methyl]-1-piperazinyl]-oxomethyl]-4-methylbenzenesulfonamide IUPAC Name: N,N-diethyl-3-[4-[(2-fluorophenyl)methyl]piperazine-1-carbonyl]-4-methylbenzenesulfonamide Traditional Name: N,N-diethyl-3-[4-(2-fluorobenzyl)piperazine-1-carbonyl]-4-methyl-benzenesulfonamide Formula: C23H30FN3O3S MolecularWeight: 447.566003

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)CC3=CC=CC=C3F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)CC3=CC=CC=C3F

InChI

InChI=1S/C23H30FN3O3S/c1-4-27(5-2)31(29,30)20-11-10-18(3)21(16-20)23(28)26-14-12-25(13-15-26)17-19-8-6-7-9-22(19)24/h6-11,16H,4-5,12-15,17H2,1-3H3