N-(3-bromophenyl)-4-methoxy-3-piperazin-1-yl-benzenesulfonamide

Systemtic Name: N-(3-bromophenyl)-4-methoxy-3-piperazin-1-yl-benzenesulfonamide Openeye Name: N-(3-bromophenyl)-4-methoxy-3-piperazin-1-yl-benzenesulfonamide CAS Name: N-(3-bromophenyl)-4-methoxy-3-(1-piperazinyl)benzenesulfonamide IUPAC Name: N-(3-bromophenyl)-4-methoxy-3-piperazin-1-ylbenzenesulfonamide Traditional Name: N-(3-bromophenyl)-4-methoxy-3-piperazino-benzenesulfonamide Formula: C17H20BrN3O3S MolecularWeight: 426.328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)Br)N3CCNCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)Br)N3CCNCC3

InChI

InChI=1S/C17H20BrN3O3S/c1-24-17-6-5-15(12-16(17)21-9-7-19-8-10-21)25(22,23)20-14-4-2-3-13(18)11-14/h2-6,11-12,19-20H,7-10H2,1H3