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S-(1,3-benzothiazol-2-yl) 2-[2,4,6-tris(bromanyl)phenoxy]propanethioate

S-(1,3-benzothiazol-2-yl) 2-[2,4,6-tris(bromanyl)phenoxy]propanethioate

Systemtic Name:S-(1,3-benzothiazol-2-yl) 2-[2,4,6-tris(bromanyl)phenoxy]propanethioate
Openeye Name:S-(1,3-benzothiazol-2-yl) 2-(2,4,6-tribromophenoxy)propanethioate
CAS Name:2-(2,4,6-tribromophenoxy)propanethioic acid S-(1,3-benzothiazol-2-yl) ester
IUPAC Name:S-(1,3-benzothiazol-2-yl) 2-(2,4,6-tribromophenoxy)propanethioate
Traditional Name:2-(2,4,6-tribromophenoxy)propanethioic acid S-(1,3-benzothiazol-2-yl) ester
Formula: C16H10Br3NO2S2
MolecularWeight: 552.0981
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)SC1=NC2=CC=CC=C2S1)OC3=C(C=C(C=C3Br)Br)Br


Isomeric SMILES

CC(C(=O)SC1=NC2=CC=CC=C2S1)OC3=C(C=C(C=C3Br)Br)Br


InChI

InChI=1S/C16H10Br3NO2S2/c1-8(22-14-10(18)6-9(17)7-11(14)19)15(21)24-16-20-12-4-2-3-5-13(12)23-16/h2-8H,1H3


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