4-chloranyl-N-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)carbamothioyl]benzamide

Systemtic Name: 4-chloranyl-N-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)carbamothioyl]benzamide Openeye Name: 4-chloro-N-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)carbamothioyl]benzamide CAS Name: 4-chloro-N-[sulfanylidene-[(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)amino]methyl]benzamide IUPAC Name: 4-chloro-N-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)carbamothioyl]benzamide Traditional Name: 4-chloro-N-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thiocarbamoyl]benzamide Formula: C17H25ClN3OS+ MolecularWeight: 354.9179

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NC(=S)NC(=O)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NC(=S)NC(=O)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C17H24ClN3OS/c1-16(2)9-13(10-17(3,4)21-16)19-15(23)20-14(22)11-5-7-12(18)8-6-11/h5-8,13,21H,9-10H2,1-4H3,(H2,19,20,22,23)/p+1