5-bromanyl-6-(2-methyl-1,3-dithian-2-yl)-1,3-benzodioxole

Systemtic Name: 5-bromanyl-6-(2-methyl-1,3-dithian-2-yl)-1,3-benzodioxole Openeye Name: 5-bromo-6-(2-methyl-1,3-dithian-2-yl)-1,3-benzodioxole CAS Name: 5-bromo-6-(2-methyl-1,3-dithian-2-yl)-1,3-benzodioxole IUPAC Name: 5-bromo-6-(2-methyl-1,3-dithian-2-yl)-1,3-benzodioxole Traditional Name: 5-bromo-6-(2-methyl-1,3-dithian-2-yl)-1,3-benzodioxole Formula: C12H13BrO2S2 MolecularWeight: 333.26442

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Descriptors Computed from Structure

Canonical SMILES:

CC1(SCCCS1)C2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CC1(SCCCS1)C2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C12H13BrO2S2/c1-12(16-3-2-4-17-12)8-5-10-11(6-9(8)13)15-7-14-10/h5-6H,2-4,7H2,1H3