N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-4-ethoxy-benzenesulfonamide

Systemtic Name: N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-4-ethoxy-benzenesulfonamide Openeye Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-4-ethoxy-benzenesulfonamide CAS Name: N-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-4-ethoxybenzenesulfonamide IUPAC Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-4-ethoxybenzenesulfonamide Traditional Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-4-ethoxy-benzenesulfonamide Formula: C18H18BrN3O3S MolecularWeight: 436.32282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

InChI

InChI=1S/C18H18BrN3O3S/c1-2-25-17-6-8-18(9-7-17)26(23,24)21-16-5-3-4-14(10-16)12-22-13-15(19)11-20-22/h3-11,13,21H,2,12H2,1H3