1-bromanyl-4-[4-(2-sulfosulfanylethylamino)butyl]benzene

Systemtic Name: 1-bromanyl-4-[4-(2-sulfosulfanylethylamino)butyl]benzene Openeye Name: 1-bromo-4-[4-(2-sulfosulfanylethylamino)butyl]benzene CAS Name: 1-bromo-4-[4-[2-(sulfothio)ethylamino]butyl]benzene IUPAC Name: 1-bromo-4-[4-(2-sulfosulfanylethylamino)butyl]benzene Traditional Name: 1-bromo-4-[4-[2-(sulfothio)ethylamino]butyl]benzene Formula: C12H18BrNO3S2 MolecularWeight: 368.31022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCNCCSS(=O)(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1CCCCNCCSS(=O)(=O)O)Br

InChI

InChI=1S/C12H18BrNO3S2/c13-12-6-4-11(5-7-12)3-1-2-8-14-9-10-18-19(15,16)17/h4-7,14H,1-3,8-10H2,(H,15,16,17)