3-(4-fluorophenyl)sulfanyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(4-fluorophenyl)sulfanyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(4-fluorophenyl)sulfanyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-[(4-fluorophenyl)thio]-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(4-fluorophenyl)sulfanyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-[(4-fluorophenyl)thio]-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]propionamide Formula: C21H26FN2O2S+ MolecularWeight: 389.506743

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)CCSC3=CC=C(C=C3)F

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN2O2S/c22-19-5-7-20(8-6-19)27-14-9-21(25)23-15-17-3-1-2-4-18(17)16-24-10-12-26-13-11-24/h1-8H,9-16H2,(H,23,25)/p+1