O-[2-(6-bromanyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethyl] [2-(6-bromanyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethoxycarbothioyldisulfanyl]methanethioate

Systemtic Name: O-[2-(6-bromanyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethyl] [2-(6-bromanyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethoxycarbothioyldisulfanyl]methanethioate Openeye Name: O-[2-(6-bromo-2-oxo-1,3-benzothiazol-3-yl)ethyl] [2-(6-bromo-2-oxo-1,3-benzothiazol-3-yl)ethoxycarbothioyldisulfanyl]methanethioate CAS Name: [[2-(6-bromo-2-oxo-1,3-benzothiazol-3-yl)ethoxy-sulfanylidenemethyl]disulfanyl]methanethioic acid O-[2-(6-bromo-2-oxo-1,3-benzothiazol-3-yl)ethyl] ester IUPAC Name: O-[2-(6-bromo-2-oxo-1,3-benzothiazol-3-yl)ethyl] [2-(6-bromo-2-oxo-1,3-benzothiazol-3-yl)ethoxycarbothioyldisulfanyl]methanethioate Traditional Name: [2-(6-bromo-2-keto-1,3-benzothiazol-3-yl)ethoxycarbothioyldisulfanyl]methanethioic acid O-[2-(6-bromo-2-keto-1,3-benzothiazol-3-yl)ethyl] ester Formula: C20H14Br2N2O4S6 MolecularWeight: 698.53416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)SC(=O)N2CCOC(=S)SSC(=S)OCCN3C4=C(C=C(C=C4)Br)SC3=O

Isomeric SMILES

C1=CC2=C(C=C1Br)SC(=O)N2CCOC(=S)SSC(=S)OCCN3C4=C(C=C(C=C4)Br)SC3=O

InChI

InChI=1S/C20H14Br2N2O4S6/c21-11-1-3-13-15(9-11)31-17(25)23(13)5-7-27-19(29)33-34-20(30)28-8-6-24-14-4-2-12(22)10-16(14)32-18(24)26/h1-4,9-10H,5-8H2