N-[2,4-bis(bromanyl)-6-nitro-phenyl]-2-(butylamino)-2-sulfanylidene-ethanamide

Systemtic Name: N-[2,4-bis(bromanyl)-6-nitro-phenyl]-2-(butylamino)-2-sulfanylidene-ethanamide Openeye Name: 2-(butylamino)-N-(2,4-dibromo-6-nitro-phenyl)-2-thioxo-acetamide CAS Name: 2-(butylamino)-N-(2,4-dibromo-6-nitrophenyl)-2-sulfanylideneacetamide IUPAC Name: 2-(butylamino)-N-(2,4-dibromo-6-nitrophenyl)-2-sulfanylideneacetamide Traditional Name: 2-(butylamino)-N-(2,4-dibromo-6-nitro-phenyl)-2-thioxo-acetamide Formula: C12H13Br2N3O3S MolecularWeight: 439.12292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)C(=O)NC1=C(C=C(C=C1[N+](=O)[O-])Br)Br

Isomeric SMILES

CCCCNC(=S)C(=O)NC1=C(C=C(C=C1[N+](=O)[O-])Br)Br

InChI

InChI=1S/C12H13Br2N3O3S/c1-2-3-4-15-12(21)11(18)16-10-8(14)5-7(13)6-9(10)17(19)20/h5-6H,2-4H2,1H3,(H,15,21)(H,16,18)