6-bromanyl-3-(4-octylphenyl)-4-sulfanylidene-1,3-benzoxazin-2-one

Systemtic Name: 6-bromanyl-3-(4-octylphenyl)-4-sulfanylidene-1,3-benzoxazin-2-one Openeye Name: 6-bromo-3-(4-octylphenyl)-4-thioxo-1,3-benzoxazin-2-one CAS Name: 6-bromo-3-(4-octylphenyl)-4-sulfanylidene-1,3-benzoxazin-2-one IUPAC Name: 6-bromo-3-(4-octylphenyl)-4-sulfanylidene-1,3-benzoxazin-2-one Traditional Name: 6-bromo-3-(4-octylphenyl)-4-thioxo-1,3-benzoxazin-2-one Formula: C22H24BrNO2S MolecularWeight: 446.40046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)N2C(=S)C3=C(C=CC(=C3)Br)OC2=O

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)N2C(=S)C3=C(C=CC(=C3)Br)OC2=O

InChI

InChI=1S/C22H24BrNO2S/c1-2-3-4-5-6-7-8-16-9-12-18(13-10-16)24-21(27)19-15-17(23)11-14-20(19)26-22(24)25/h9-15H,2-8H2,1H3