5-bromanyl-N-(4-methylpiperazin-4-ium-1-yl)carbothioyl-furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-(4-methylpiperazin-4-ium-1-yl)carbothioyl-furan-2-carboxamide Openeye Name: 5-bromo-N-(4-methylpiperazin-4-ium-1-carbothioyl)furan-2-carboxamide CAS Name: 5-bromo-N-[(4-methyl-1-piperazin-4-iumyl)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-(4-methylpiperazin-4-ium-1-carbothioyl)furan-2-carboxamide Traditional Name: 5-bromo-N-(4-methylpiperazin-4-ium-1-carbothioyl)-2-furamide Formula: C11H15BrN3O2S+ MolecularWeight: 333.2247

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=S)NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

C[NH+]1CCN(CC1)C(=S)NC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C11H14BrN3O2S/c1-14-4-6-15(7-5-14)11(18)13-10(16)8-2-3-9(12)17-8/h2-3H,4-7H2,1H3,(H,13,16,18)/p+1