5-[(3-chlorophenyl)methylsulfanylmethyl]-N-(3-morpholin-4-ium-4-ylpropyl)furan-2-carboxamide

Systemtic Name: 5-[(3-chlorophenyl)methylsulfanylmethyl]-N-(3-morpholin-4-ium-4-ylpropyl)furan-2-carboxamide Openeye Name: 5-[(3-chlorophenyl)methylsulfanylmethyl]-N-(3-morpholin-4-ium-4-ylpropyl)furan-2-carboxamide CAS Name: 5-[[(3-chlorophenyl)methylthio]methyl]-N-[3-(4-morpholin-4-iumyl)propyl]-2-furancarboxamide IUPAC Name: 5-[(3-chlorophenyl)methylsulfanylmethyl]-N-(3-morpholin-4-ium-4-ylpropyl)furan-2-carboxamide Traditional Name: 5-[[(3-chlorobenzyl)thio]methyl]-N-(3-morpholin-4-ium-4-ylpropyl)-2-furamide Formula: C20H26ClN2O3S+ MolecularWeight: 409.95004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=CC=C(O2)CSCC3=CC(=CC=C3)Cl

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=CC=C(O2)CSCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H25ClN2O3S/c21-17-4-1-3-16(13-17)14-27-15-18-5-6-19(26-18)20(24)22-7-2-8-23-9-11-25-12-10-23/h1,3-6,13H,2,7-12,14-15H2,(H,22,24)/p+1