5-bromanyl-2-chloranyl-N-(3-morpholin-4-ium-4-ylpropylcarbamothioyl)benzamide

Systemtic Name: 5-bromanyl-2-chloranyl-N-(3-morpholin-4-ium-4-ylpropylcarbamothioyl)benzamide Openeye Name: 5-bromo-2-chloro-N-(3-morpholin-4-ium-4-ylpropylcarbamothioyl)benzamide CAS Name: 5-bromo-2-chloro-N-[[3-(4-morpholin-4-iumyl)propylamino]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-chloro-N-(3-morpholin-4-ium-4-ylpropylcarbamothioyl)benzamide Traditional Name: 5-bromo-2-chloro-N-(3-morpholin-4-ium-4-ylpropylthiocarbamoyl)benzamide Formula: C15H20BrClN3O2S+ MolecularWeight: 421.7602

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=S)NC(=O)C2=C(C=CC(=C2)Br)Cl

Isomeric SMILES

C1COCC[NH+]1CCCNC(=S)NC(=O)C2=C(C=CC(=C2)Br)Cl

InChI

InChI=1S/C15H19BrClN3O2S/c16-11-2-3-13(17)12(10-11)14(21)19-15(23)18-4-1-5-20-6-8-22-9-7-20/h2-3,10H,1,4-9H2,(H2,18,19,21,23)/p+1