4-bromanyl-4-iodanyl-N-(4-piperazin-1-ylnaphthalen-1-yl)cyclohexa-1,5-diene-1-sulfonamide

Systemtic Name: 4-bromanyl-4-iodanyl-N-(4-piperazin-1-ylnaphthalen-1-yl)cyclohexa-1,5-diene-1-sulfonamide Openeye Name: 4-bromo-4-iodo-N-(4-piperazin-1-yl-1-naphthyl)cyclohexa-1,5-diene-1-sulfonamide CAS Name: 4-bromo-4-iodo-N-[4-(1-piperazinyl)-1-naphthalenyl]-1-cyclohexa-1,5-dienesulfonamide IUPAC Name: 4-bromo-4-iodo-N-(4-piperazin-1-ylnaphthalen-1-yl)cyclohexa-1,5-diene-1-sulfonamide Traditional Name: 4-bromo-4-iodo-N-(4-piperazino-1-naphthyl)cyclohexa-1,5-diene-1-sulfonamide Formula: C20H21BrIN3O2S MolecularWeight: 574.27311

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=C(C3=CC=CC=C32)NS(=O)(=O)C4=CCC(C=C4)(Br)I

Isomeric SMILES

C1CN(CCN1)C2=CC=C(C3=CC=CC=C32)NS(=O)(=O)C4=CCC(C=C4)(Br)I

InChI

InChI=1S/C20H21BrIN3O2S/c21-20(22)9-7-15(8-10-20)28(26,27)24-18-5-6-19(25-13-11-23-12-14-25)17-4-2-1-3-16(17)18/h1-9,23-24H,10-14H2