5-bromanyl-2-methoxy-N-(4-piperazin-1-ylnaphthalen-1-yl)benzenesulfonamide

Systemtic Name: 5-bromanyl-2-methoxy-N-(4-piperazin-1-ylnaphthalen-1-yl)benzenesulfonamide Openeye Name: 5-bromo-2-methoxy-N-(4-piperazin-1-yl-1-naphthyl)benzenesulfonamide CAS Name: 5-bromo-2-methoxy-N-[4-(1-piperazinyl)-1-naphthalenyl]benzenesulfonamide IUPAC Name: 5-bromo-2-methoxy-N-(4-piperazin-1-ylnaphthalen-1-yl)benzenesulfonamide Traditional Name: 5-bromo-2-methoxy-N-(4-piperazino-1-naphthyl)benzenesulfonamide Formula: C21H22BrN3O3S MolecularWeight: 476.38668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C3=CC=CC=C32)N4CCNCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C3=CC=CC=C32)N4CCNCC4

InChI

InChI=1S/C21H22BrN3O3S/c1-28-20-9-6-15(22)14-21(20)29(26,27)24-18-7-8-19(25-12-10-23-11-13-25)17-5-3-2-4-16(17)18/h2-9,14,23-24H,10-13H2,1H3