6,8-bis(bromanyl)-3-(4-hexylphenyl)-4-sulfanylidene-1,3-benzoxazin-2-one

Systemtic Name: 6,8-bis(bromanyl)-3-(4-hexylphenyl)-4-sulfanylidene-1,3-benzoxazin-2-one Openeye Name: 6,8-dibromo-3-(4-hexylphenyl)-4-thioxo-1,3-benzoxazin-2-one CAS Name: 6,8-dibromo-3-(4-hexylphenyl)-4-sulfanylidene-1,3-benzoxazin-2-one IUPAC Name: 6,8-dibromo-3-(4-hexylphenyl)-4-sulfanylidene-1,3-benzoxazin-2-one Traditional Name: 6,8-dibromo-3-(4-hexylphenyl)-4-thioxo-1,3-benzoxazin-2-one Formula: C20H19Br2NO2S MolecularWeight: 497.24336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)N2C(=S)C3=CC(=CC(=C3OC2=O)Br)Br

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)N2C(=S)C3=CC(=CC(=C3OC2=O)Br)Br

InChI

InChI=1S/C20H19Br2NO2S/c1-2-3-4-5-6-13-7-9-15(10-8-13)23-19(26)16-11-14(21)12-17(22)18(16)25-20(23)24/h7-12H,2-6H2,1H3