methyl 4-[[[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-(dimethylamino)methylidene]amino]benzoate hydrobromide

Systemtic Name: methyl 4-[[[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-(dimethylamino)methylidene]amino]benzoate hydrobromide Openeye Name: methyl 4-[[[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-(dimethylamino)methylene]amino]benzoate hydrobromide CAS Name: 4-[[[[2-(4-bromophenyl)-2-oxoethyl]thio]-(dimethylamino)methylidene]amino]benzoic acid methyl ester hydrobromide IUPAC Name: methyl 4-[[[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-(dimethylamino)methylidene]amino]benzoate hydrobromide Traditional Name: 4-[[[[2-(4-bromophenyl)-2-keto-ethyl]thio]-(dimethylamino)methylene]amino]benzoic acid methyl ester hydrobromide Formula: C19H20Br2N2O3S MolecularWeight: 516.2467

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=NC1=CC=C(C=C1)C(=O)OC)SCC(=O)C2=CC=C(C=C2)Br.Br

Isomeric SMILES

CN(C)C(=NC1=CC=C(C=C1)C(=O)OC)SCC(=O)C2=CC=C(C=C2)Br.Br

InChI

InChI=1S/C19H19BrN2O3S.BrH/c1-22(2)19(21-16-10-6-14(7-11-16)18(24)25-3)26-12-17(23)13-4-8-15(20)9-5-13;/h4-11H,12H2,1-3H3;1H