N-[5-bromanyl-3-[(4-ethylphenyl)methoxy]pyrazin-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[5-bromanyl-3-[(4-ethylphenyl)methoxy]pyrazin-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[5-bromo-3-[(4-ethylphenyl)methoxy]pyrazin-2-yl]-4-methyl-benzenesulfonamide CAS Name: N-[5-bromo-3-[(4-ethylphenyl)methoxy]-2-pyrazinyl]-4-methylbenzenesulfonamide IUPAC Name: N-[5-bromo-3-[(4-ethylphenyl)methoxy]pyrazin-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[5-bromo-3-(4-ethylbenzyl)oxy-pyrazin-2-yl]-4-methyl-benzenesulfonamide Formula: C20H20BrN3O3S MolecularWeight: 462.3601

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)COC2=NC(=CN=C2NS(=O)(=O)C3=CC=C(C=C3)C)Br

Isomeric SMILES

CCC1=CC=C(C=C1)COC2=NC(=CN=C2NS(=O)(=O)C3=CC=C(C=C3)C)Br

InChI

InChI=1S/C20H20BrN3O3S/c1-3-15-6-8-16(9-7-15)13-27-20-19(22-12-18(21)23-20)24-28(25,26)17-10-4-14(2)5-11-17/h4-12H,3,13H2,1-2H3,(H,22,24)