4-bromanyl-2-ethyl-N,N-bis(pyridin-2-ylmethyl)benzenesulfonamide

Systemtic Name: 4-bromanyl-2-ethyl-N,N-bis(pyridin-2-ylmethyl)benzenesulfonamide Openeye Name: 4-bromo-2-ethyl-N,N-bis(2-pyridylmethyl)benzenesulfonamide CAS Name: 4-bromo-2-ethyl-N,N-bis(2-pyridinylmethyl)benzenesulfonamide IUPAC Name: 4-bromo-2-ethyl-N,N-bis(pyridin-2-ylmethyl)benzenesulfonamide Traditional Name: 4-bromo-2-ethyl-N,N-bis(2-pyridylmethyl)benzenesulfonamide Formula: C20H20BrN3O2S MolecularWeight: 446.3607

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N(CC2=CC=CC=N2)CC3=CC=CC=N3

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N(CC2=CC=CC=N2)CC3=CC=CC=N3

InChI

InChI=1S/C20H20BrN3O2S/c1-2-16-13-17(21)9-10-20(16)27(25,26)24(14-18-7-3-5-11-22-18)15-19-8-4-6-12-23-19/h3-13H,2,14-15H2,1H3