4-bromanyl-N-[methyl-(1-methylpiperidin-1-ium-4-yl)carbamothioyl]benzamide

Systemtic Name: 4-bromanyl-N-[methyl-(1-methylpiperidin-1-ium-4-yl)carbamothioyl]benzamide Openeye Name: 4-bromo-N-[methyl-(1-methylpiperidin-1-ium-4-yl)carbamothioyl]benzamide CAS Name: 4-bromo-N-[[methyl-(1-methyl-4-piperidin-1-iumyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-bromo-N-[methyl-(1-methylpiperidin-1-ium-4-yl)carbamothioyl]benzamide Traditional Name: 4-bromo-N-[methyl-(1-methylpiperidin-1-ium-4-yl)thiocarbamoyl]benzamide Formula: C15H21BrN3OS+ MolecularWeight: 371.31574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20BrN3OS/c1-18-9-7-13(8-10-18)19(2)15(21)17-14(20)11-3-5-12(16)6-4-11/h3-6,13H,7-10H2,1-2H3,(H,17,20,21)/p+1