4-chloranyl-N-(2-morpholin-4-ium-4-ylethyl)benzenecarbothioamide

Systemtic Name: 4-chloranyl-N-(2-morpholin-4-ium-4-ylethyl)benzenecarbothioamide Openeye Name: 4-chloro-N-(2-morpholin-4-ium-4-ylethyl)benzenecarbothioamide CAS Name: 4-chloro-N-[2-(4-morpholin-4-iumyl)ethyl]benzenecarbothioamide IUPAC Name: 4-chloro-N-(2-morpholin-4-ium-4-ylethyl)benzenecarbothioamide Traditional Name: 4-chloro-N-(2-morpholin-4-ium-4-ylethyl)thiobenzamide Formula: C13H18ClN2OS+ MolecularWeight: 285.81282

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H17ClN2OS/c14-12-3-1-11(2-4-12)13(18)15-5-6-16-7-9-17-10-8-16/h1-4H,5-10H2,(H,15,18)/p+1