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5,8-bis(2-bromoethylamino)benzo[f][1]benzothiole-4,9-dione

5,8-bis(2-bromoethylamino)benzo[f][1]benzothiole-4,9-dione

Systemtic Name:5,8-bis(2-bromoethylamino)benzo[f][1]benzothiole-4,9-dione
Openeye Name:5,8-bis(2-bromoethylamino)benzo[f]benzothiophene-4,9-dione
CAS Name:5,8-bis(2-bromoethylamino)benzo[f][1]benzothiole-4,9-dione
IUPAC Name:5,8-bis(2-bromoethylamino)benzo[f][1]benzothiole-4,9-dione
Traditional Name:5,8-bis(2-bromoethylamino)benzo[f]benzothiophene-4,9-quinone
Formula: C16H14Br2N2O2S
MolecularWeight: 458.16756
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1NCCBr)C(=O)C3=C(C2=O)SC=C3)NCCBr


Isomeric SMILES

C1=CC(=C2C(=C1NCCBr)C(=O)C3=C(C2=O)SC=C3)NCCBr


InChI

InChI=1S/C16H14Br2N2O2S/c17-4-6-19-10-1-2-11(20-7-5-18)13-12(10)14(21)9-3-8-23-16(9)15(13)22/h1-3,8,19-20H,4-7H2


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