5-[(3-bromophenyl)methylidene]-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[(3-bromophenyl)methylidene]-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[(3-bromophenyl)methylene]-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-2-thioxo-thiazolidin-4-one CAS Name: 5-[(3-bromophenyl)methylidene]-3-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[(3-bromophenyl)methylidene]-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-(3-bromobenzylidene)-3-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-2-thioxo-thiazolidin-4-one Formula: C17H19BrN3O2S2+ MolecularWeight: 441.38566

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN2C(=O)C(=CC3=CC(=CC=C3)Br)SC2=S

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN2C(=O)C(=CC3=CC(=CC=C3)Br)SC2=S

InChI

InChI=1S/C17H18BrN3O2S2/c1-19-5-7-20(8-6-19)15(22)11-21-16(23)14(25-17(21)24)10-12-3-2-4-13(18)9-12/h2-4,9-10H,5-8,11H2,1H3/p+1