[6,8-bis(bromanyl)-4-oxidanylidene-2-phenyl-2,3-dihydrochromen-3-yl] N,N-diethylcarbamodithioate

Systemtic Name: [6,8-bis(bromanyl)-4-oxidanylidene-2-phenyl-2,3-dihydrochromen-3-yl] N,N-diethylcarbamodithioate Openeye Name: (6,8-dibromo-4-oxo-2-phenyl-chroman-3-yl) N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid (6,8-dibromo-4-oxo-2-phenyl-3,4-dihydro-2H-1-benzopyran-3-yl) ester IUPAC Name: (6,8-dibromo-4-oxo-2-phenyl-2,3-dihydrochromen-3-yl) N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid (6,8-dibromo-4-keto-2-phenyl-chroman-3-yl) ester Formula: C20H19Br2NO2S2 MolecularWeight: 529.30836

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SC1C(OC2=C(C=C(C=C2C1=O)Br)Br)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=S)SC1C(OC2=C(C=C(C=C2C1=O)Br)Br)C3=CC=CC=C3

InChI

InChI=1S/C20H19Br2NO2S2/c1-3-23(4-2)20(26)27-19-16(24)14-10-13(21)11-15(22)18(14)25-17(19)12-8-6-5-7-9-12/h5-11,17,19H,3-4H2,1-2H3