2-bromanyl-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)benzenesulfonamide

Systemtic Name: 2-bromanyl-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)benzenesulfonamide Openeye Name: 2-bromo-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]benzenesulfonamide CAS Name: 2-bromo-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]benzenesulfonamide IUPAC Name: 2-bromo-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)benzenesulfonamide Traditional Name: 2-bromo-N-(4-methyl-3-piperidinosulfonyl-phenyl)benzenesulfonamide Formula: C18H21BrN2O4S2 MolecularWeight: 473.40434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC=C2Br)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC=C2Br)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H21BrN2O4S2/c1-14-9-10-15(20-26(22,23)17-8-4-3-7-16(17)19)13-18(14)27(24,25)21-11-5-2-6-12-21/h3-4,7-10,13,20H,2,5-6,11-12H2,1H3