4-bromanyl-N,N-diethyl-3-(4-methylsulfonylpiperazin-1-yl)carbonyl-benzenesulfonamide

Systemtic Name: 4-bromanyl-N,N-diethyl-3-(4-methylsulfonylpiperazin-1-yl)carbonyl-benzenesulfonamide Openeye Name: 4-bromo-N,N-diethyl-3-(4-methylsulfonylpiperazine-1-carbonyl)benzenesulfonamide CAS Name: 4-bromo-N,N-diethyl-3-[(4-methylsulfonyl-1-piperazinyl)-oxomethyl]benzenesulfonamide IUPAC Name: 4-bromo-N,N-diethyl-3-(4-methylsulfonylpiperazine-1-carbonyl)benzenesulfonamide Traditional Name: 4-bromo-N,N-diethyl-3-(4-mesylpiperazine-1-carbonyl)benzenesulfonamide Formula: C16H24BrN3O5S2 MolecularWeight: 482.41286

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)N2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)N2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C16H24BrN3O5S2/c1-4-19(5-2)27(24,25)13-6-7-15(17)14(12-13)16(21)18-8-10-20(11-9-18)26(3,22)23/h6-7,12H,4-5,8-11H2,1-3H3