2-methylsulfanyl-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 2-methylsulfanyl-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]benzamide Openeye Name: 2-methylsulfanyl-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]benzamide CAS Name: 2-(methylthio)-N-[[4-(4-morpholin-4-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 2-methylsulfanyl-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]benzamide Traditional Name: 2-(methylthio)-N-[4-(morpholin-4-ium-4-ylmethyl)benzyl]benzamide Formula: C20H25N2O2S+ MolecularWeight: 357.4897

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)NCC2=CC=C(C=C2)C[NH+]3CCOCC3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)NCC2=CC=C(C=C2)C[NH+]3CCOCC3

InChI

InChI=1S/C20H24N2O2S/c1-25-19-5-3-2-4-18(19)20(23)21-14-16-6-8-17(9-7-16)15-22-10-12-24-13-11-22/h2-9H,10-15H2,1H3,(H,21,23)/p+1