4-[(5-bromanyl-2-oxidanyl-phenyl)methylamino]-N-(3-methoxypyrazin-2-yl)benzenesulfonamide

Systemtic Name: 4-[(5-bromanyl-2-oxidanyl-phenyl)methylamino]-N-(3-methoxypyrazin-2-yl)benzenesulfonamide Openeye Name: 4-[(5-bromo-2-hydroxy-phenyl)methylamino]-N-(3-methoxypyrazin-2-yl)benzenesulfonamide CAS Name: 4-[(5-bromo-2-hydroxyphenyl)methylamino]-N-(3-methoxy-2-pyrazinyl)benzenesulfonamide IUPAC Name: 4-[(5-bromo-2-hydroxyphenyl)methylamino]-N-(3-methoxypyrazin-2-yl)benzenesulfonamide Traditional Name: 4-[(5-bromo-2-hydroxy-benzyl)amino]-N-(3-methoxypyrazin-2-yl)benzenesulfonamide Formula: C18H17BrN4O4S MolecularWeight: 465.32098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=CN=C1NS(=O)(=O)C2=CC=C(C=C2)NCC3=C(C=CC(=C3)Br)O

Isomeric SMILES

COC1=NC=CN=C1NS(=O)(=O)C2=CC=C(C=C2)NCC3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C18H17BrN4O4S/c1-27-18-17(20-8-9-21-18)23-28(25,26)15-5-3-14(4-6-15)22-11-12-10-13(19)2-7-16(12)24/h2-10,22,24H,11H2,1H3,(H,20,23)