2-(piperidin-1-ium-1-ylmethyl)benzenecarbothioamide

Systemtic Name: 2-(piperidin-1-ium-1-ylmethyl)benzenecarbothioamide Openeye Name: 2-(piperidin-1-ium-1-ylmethyl)benzenecarbothioamide CAS Name: 2-(1-piperidin-1-iumylmethyl)benzenecarbothioamide IUPAC Name: 2-(piperidin-1-ium-1-ylmethyl)benzenecarbothioamide Traditional Name: 2-(piperidin-1-ium-1-ylmethyl)thiobenzamide Formula: C13H19N2S+ MolecularWeight: 235.36836

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=CC=C2C(=S)N

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=CC=C2C(=S)N

InChI

InChI=1S/C13H18N2S/c14-13(16)12-7-3-2-6-11(12)10-15-8-4-1-5-9-15/h2-3,6-7H,1,4-5,8-10H2,(H2,14,16)/p+1