4-[(4-chlorophenyl)sulfanylmethyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide

Systemtic Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Openeye Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide CAS Name: 4-[[(4-chlorophenyl)thio]methyl]-N-[2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Formula: C20H24ClN2O2S+ MolecularWeight: 391.93476

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H23ClN2O2S/c21-18-5-7-19(8-6-18)26-15-16-1-3-17(4-2-16)20(24)22-9-10-23-11-13-25-14-12-23/h1-8H,9-15H2,(H,22,24)/p+1